methyl 4-[4-aminocarbonyl-2-(3-methoxy-3-oxidanylidene-propyl)-5-methyl-1-(phenylmethyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2-(3-methoxy-3-oxidanylidene-propyl)-5-methyl-1-(phenylmethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[1-benzyl-4-carbamoyl-2-(3-methoxy-3-oxo-propyl)-5-methyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-2-(3-methoxy-3-oxopropyl)-5-methyl-1-(phenylmethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-benzyl-4-carbamoyl-2-(3-methoxy-3-oxopropyl)-5-methylpyrrol-3-yl]benzoate Traditional Name: 4-[1-benzyl-4-carbamoyl-2-(3-keto-3-methoxy-propyl)-5-methyl-pyrrol-3-yl]benzoic acid methyl ester Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2)CCC(=O)OC)C3=CC=C(C=C3)C(=O)OC)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2)CCC(=O)OC)C3=CC=C(C=C3)C(=O)OC)C(=O)N

InChI

InChI=1S/C25H26N2O5/c1-16-22(24(26)29)23(18-9-11-19(12-10-18)25(30)32-3)20(13-14-21(28)31-2)27(16)15-17-7-5-4-6-8-17/h4-12H,13-15H2,1-3H3,(H2,26,29)