ethyl 1-[3-[(2,5-dimethylphenyl)amino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-[(2,5-dimethylphenyl)amino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(2,5-dimethylanilino)-3-oxo-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[3-(2,5-dimethylanilino)-3-oxopropyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2,5-dimethylanilino)-3-oxopropyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-(2,5-dimethylanilino)-3-keto-propyl]-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)CCC(=O)NC3=C(C=CC(=C3)C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O3/c1-5-30-25(29)21-16-23(20-9-7-6-8-10-20)27(19(21)4)14-13-24(28)26-22-15-17(2)11-12-18(22)3/h6-12,15-16H,5,13-14H2,1-4H3,(H,26,28)