ethyl 1-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H23ClN2O3 MolecularWeight: 410.89332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C23H23ClN2O3/c1-3-29-23(28)20-13-21(18-7-5-4-6-8-18)26(16(20)2)15-22(27)25-14-17-9-11-19(24)12-10-17/h4-13H,3,14-15H2,1-2H3,(H,25,27)