ethyl 1-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-keto-3-[4-(4-methoxyphenyl)piperazino]propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C28H33N3O4/c1-4-35-28(33)25-20-26(22-8-6-5-7-9-22)31(21(25)2)15-14-27(32)30-18-16-29(17-19-30)23-10-12-24(34-3)13-11-23/h5-13,20H,4,14-19H2,1-3H3