1-[(4-methoxyphenyl)methyl]-6-methyl-3-[[(4-methylcyclohexyl)amino]methyl]indole-2-carboxylic acid

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-6-methyl-3-[[(4-methylcyclohexyl)amino]methyl]indole-2-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)methyl]-6-methyl-3-[[(4-methylcyclohexyl)amino]methyl]indole-2-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)methyl]-6-methyl-3-[[(4-methylcyclohexyl)amino]methyl]-2-indolecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)methyl]-6-methyl-3-[[(4-methylcyclohexyl)amino]methyl]indole-2-carboxylic acid Traditional Name: 6-methyl-3-[[(4-methylcyclohexyl)amino]methyl]-1-p-anisyl-indole-2-carboxylic acid Formula: C26H32N2O3 MolecularWeight: 420.54388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NCC2=C(N(C3=C2C=CC(=C3)C)CC4=CC=C(C=C4)OC)C(=O)O

Isomeric SMILES

CC1CCC(CC1)NCC2=C(N(C3=C2C=CC(=C3)C)CC4=CC=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C26H32N2O3/c1-17-4-9-20(10-5-17)27-15-23-22-13-6-18(2)14-24(22)28(25(23)26(29)30)16-19-7-11-21(31-3)12-8-19/h6-8,11-14,17,20,27H,4-5,9-10,15-16H2,1-3H3,(H,29,30)