Molecule ID: 257434

IUPAC Name: 4-ethyl-3-(4-methoxyphenyl)-2,2-dimethyl-8-(pyrrolidin-1-ylmethyl)chromen-7-ol

Description: The molecule is a member of the class of chromenes that is 2H-1-benzopyran substituted by methyl groups at positions 2 and 2, an ethyl group at position 4 and a 4-methoxyphenyl group at position 3 respectively. It is a member of pyrrolidines, a monomethoxybenzene, a member of phenols and a member of chromenes.

SMILES: CCC1=C(c2ccc(OC)cc2)C(C)(C)Oc2c1ccc(O)c2CN1CCCC1

SELFIES: [C][C][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][Branch1][C][C][Branch1][C][C][O][C][=C][Ring1][S][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][N][C][C][C][C][Ring1][Branch1]

InChI: InChI=1S/C25H31NO3/c1-5-19-20-12-13-22(27)21(16-26-14-6-7-15-26)24(20)29-25(2,3)23(19)17-8-10-18(28-4)11-9-17/h8-13,27H,5-7,14-16H2,1-4H3

Molecular Properties:
- Polar Surface Area: 41.9 Ų
- LogP: 4.3