6-(1-cyclohexylethenyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-(1-cyclohexylethenyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(1-cyclohexylvinyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(1-cyclohexylethenyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(1-cyclohexylethenyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(1-cyclohexylvinyl)-4-methyl-9H-$b-carboline-3-carboxylic acid Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3=C(C=CC(=C3)C(=C)C4CCCCC4)NC2=CN=C1C(=O)O

Isomeric SMILES

CC1=C2C3=C(C=CC(=C3)C(=C)C4CCCCC4)NC2=CN=C1C(=O)O

InChI

InChI=1S/C21H22N2O2/c1-12(14-6-4-3-5-7-14)15-8-9-17-16(10-15)19-13(2)20(21(24)25)22-11-18(19)23-17/h8-11,14,23H,1,3-7H2,2H3,(H,24,25)