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

Systemtic Name: 2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-[(1-phenylethylamino)methyl]pyrrole-3-carboxylic acid Openeye Name: 2,5-dimethyl-4-[(1-phenylethylamino)methyl]-1-(p-tolylmethyl)pyrrole-3-carboxylic acid CAS Name: 2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-[(1-phenylethylamino)methyl]-3-pyrrolecarboxylic acid IUPAC Name: 2,5-dimethyl-1-[(4-methylphenyl)methyl]-4-[(1-phenylethylamino)methyl]pyrrole-3-carboxylic acid Traditional Name: 2,5-dimethyl-1-(4-methylbenzyl)-4-[(1-phenylethylamino)methyl]pyrrole-3-carboxylic acid Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=C2C)C(=O)O)CNC(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=C2C)C(=O)O)CNC(C)C3=CC=CC=C3)C

InChI

InChI=1S/C24H28N2O2/c1-16-10-12-20(13-11-16)15-26-18(3)22(23(19(26)4)24(27)28)14-25-17(2)21-8-6-5-7-9-21/h5-13,17,25H,14-15H2,1-4H3,(H,27,28)