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

Systemtic Name: ethyl 1-[3-[(5-chloranyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(5-chloro-2-methyl-anilino)-3-oxo-propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 1-[3-(5-chloro-2-methylanilino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(5-chloro-2-methylanilino)-3-oxopropyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 1-[3-(5-chloro-2-methyl-anilino)-3-keto-propyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C25H27ClN2O3 MolecularWeight: 438.94648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN2O3/c1-5-31-25(30)21-15-23(19-9-6-16(2)7-10-19)28(18(21)4)13-12-24(29)27-22-14-20(26)11-8-17(22)3/h6-11,14-15H,5,12-13H2,1-4H3,(H,27,29)