2,5-dimethyl-4-[[(2-methylcyclohexyl)amino]methyl]-1-[(2-methylphenyl)methyl]pyrrole-3-carboxylic acid

Systemtic Name: 2,5-dimethyl-4-[[(2-methylcyclohexyl)amino]methyl]-1-[(2-methylphenyl)methyl]pyrrole-3-carboxylic acid Openeye Name: 2,5-dimethyl-4-[[(2-methylcyclohexyl)amino]methyl]-1-(o-tolylmethyl)pyrrole-3-carboxylic acid CAS Name: 2,5-dimethyl-4-[[(2-methylcyclohexyl)amino]methyl]-1-[(2-methylphenyl)methyl]-3-pyrrolecarboxylic acid IUPAC Name: 2,5-dimethyl-4-[[(2-methylcyclohexyl)amino]methyl]-1-[(2-methylphenyl)methyl]pyrrole-3-carboxylic acid Traditional Name: 2,5-dimethyl-1-(2-methylbenzyl)-4-[[(2-methylcyclohexyl)amino]methyl]pyrrole-3-carboxylic acid Formula: C23H32N2O2 MolecularWeight: 368.51238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NCC2=C(N(C(=C2C(=O)O)C)CC3=CC=CC=C3C)C

Isomeric SMILES

CC1CCCCC1NCC2=C(N(C(=C2C(=O)O)C)CC3=CC=CC=C3C)C

InChI

InChI=1S/C23H32N2O2/c1-15-9-5-7-11-19(15)14-25-17(3)20(22(18(25)4)23(26)27)13-24-21-12-8-6-10-16(21)2/h5,7,9,11,16,21,24H,6,8,10,12-14H2,1-4H3,(H,26,27)