Molecule ID: 2724075

IUPAC Name: 2-methoxy-4-nitrobenzenediazonium;5-sulfonaphthalene-1-sulfonate

Description: The molecule is an organosulfonate salt composed from 2-methoxy-4-nitrobenzene-1-diazonium and 5-sulfonaphthalene-1-sulfonate in a 1:1 ratio. Used for demostrating enterochromaffin in carcinoid tumours. It has a role as a histological dye. It contains a 2-methoxy-4-nitrobenzenediazonium.

SMILES: COc1cc([N+](=O)[O-])ccc1[N+]#N.O=S(=O)([O-])c1cccc2c(S(=O)(=O)O)cccc12

SELFIES: [C][O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][N+1][#N].[O][=S][=Branch1][C][=O][Branch1][C][O-1][C][=C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][Ring1][=C][Ring1][#Branch2]

InChI: InChI=1S/C10H8O6S2.C7H6N3O3/c11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16;1-13-7-4-5(10(11)12)2-3-6(7)9-8/h1-6H,(H,11,12,13)(H,14,15,16);2-4H,1H3/q;+1/p-1

Molecular Properties:
- Polar Surface Area: 212.0 Ų
- LogP: nan