Molecule ID: 11217472

IUPAC Name: 3-[(E)-2-isocyanoethenyl]-1H-indole

Description: The molecule is an isocyanide that is indole which is substituted at position 3 by a 2-isocyanovinyl group. The Z isomer has been isolated from a Pseudomonas species and has antibacterial properties. It is a member of indoles, an isocyanide and an olefinic compound.

SMILES: [C-]#[N+]/C=C/c1c[nH]c2ccccc12

SELFIES: [C-1][#N+1][/C][=C][/C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]

InChI: InChI=1S/C11H8N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-8,13H/b7-6+

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 2.4