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

Systemtic Name: ethyl 1-[3-[(2-ethylphenyl)amino]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(2-ethylanilino)-3-oxo-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[3-(2-ethylanilino)-3-oxopropyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-ethylanilino)-3-oxopropyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-(2-ethylanilino)-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:

CCC1=CC=CC=C1NC(=O)CCN2C(=C(C=C2C3=CC=CC=C3)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CCN2C(=C(C=C2C3=CC=CC=C3)C(=O)OCC)C

InChI

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