ethyl 2-methyl-1-[4-[(4-methylphenyl)amino]-4-oxidanylidene-butyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[4-[(4-methylphenyl)amino]-4-oxidanylidene-butyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[4-(4-methylanilino)-4-oxo-butyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[4-(4-methylanilino)-4-oxobutyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[4-(4-methylanilino)-4-oxobutyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[4-keto-4-(p-toluidino)butyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCCC(=O)NC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCCC(=O)NC3=CC=C(C=C3)C)C

InChI

InChI=1S/C25H28N2O3/c1-4-30-25(29)22-17-23(20-9-6-5-7-10-20)27(19(22)3)16-8-11-24(28)26-21-14-12-18(2)13-15-21/h5-7,9-10,12-15,17H,4,8,11,16H2,1-3H3,(H,26,28)