5-(4-cyanobutyl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid

Systemtic Name: 5-(4-cyanobutyl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid Openeye Name: 5-(4-cyanobutyl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid CAS Name: 5-(4-cyanobutyl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid IUPAC Name: 5-(4-cyanobutyl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid Traditional Name: 5-(4-cyanobutyl)-7,8,9,10-tetrahydro-6H-cyclohept[b]indole-4-carboxylic acid Formula: C19H22N2O2 MolecularWeight: 310.39018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)N(C3=C2C=CC=C3C(=O)O)CCCCC#N

Isomeric SMILES

C1CCC2=C(CC1)N(C3=C2C=CC=C3C(=O)O)CCCCC#N

InChI

InChI=1S/C19H22N2O2/c20-12-5-2-6-13-21-17-11-4-1-3-8-14(17)15-9-7-10-16(18(15)21)19(22)23/h7,9-10H,1-6,8,11,13H2,(H,22,23)