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

Systemtic Name: ethyl 4-[(4-aminocarbonylphenyl)amino]-2-methyl-5-oxidanylidene-1-phenyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-(4-carbamoylanilino)-2-methyl-5-oxo-1-phenyl-pyrrole-2-carboxylate CAS Name: 4-(4-carbamoylanilino)-2-methyl-5-oxo-1-phenyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-carbamoylanilino)-2-methyl-5-oxo-1-phenylpyrrole-2-carboxylate Traditional Name: 4-(4-carbamoylanilino)-5-keto-2-methyl-1-phenyl-3-pyrroline-2-carboxylic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=C(C(=O)N1C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1(C=C(C(=O)N1C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)N)C

InChI

InChI=1S/C21H21N3O4/c1-3-28-20(27)21(2)13-17(19(26)24(21)16-7-5-4-6-8-16)23-15-11-9-14(10-12-15)18(22)25/h4-13,23H,3H2,1-2H3,(H2,22,25)