(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolecarboxylic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OC(C3=CC=CC=C3)C(=O)N)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OC(C3=CC=CC=C3)C(=O)N)C

InChI

InChI=1S/C22H22N2O3/c1-14-9-11-18(12-10-14)24-15(2)13-19(16(24)3)22(26)27-20(21(23)25)17-7-5-4-6-8-17/h4-13,20H,1-3H3,(H2,23,25)