methyl 3-[1-[2-(2-methyl-5-phenyl-1H-pyrrol-3-yl)-2-oxidanylidene-ethanoyl]piperidin-4-yl]benzoate

Systemtic Name: methyl 3-[1-[2-(2-methyl-5-phenyl-1H-pyrrol-3-yl)-2-oxidanylidene-ethanoyl]piperidin-4-yl]benzoate Openeye Name: methyl 3-[1-[2-(2-methyl-5-phenyl-1H-pyrrol-3-yl)-2-oxo-acetyl]-4-piperidyl]benzoate CAS Name: 3-[1-[2-(2-methyl-5-phenyl-1H-pyrrol-3-yl)-1,2-dioxoethyl]-4-piperidinyl]benzoic acid methyl ester IUPAC Name: methyl 3-[1-[2-(2-methyl-5-phenyl-1H-pyrrol-3-yl)-2-oxoacetyl]piperidin-4-yl]benzoate Traditional Name: 3-[1-[2-keto-2-(2-methyl-5-phenyl-1H-pyrrol-3-yl)acetyl]-4-piperidyl]benzoic acid methyl ester Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1)C2=CC=CC=C2)C(=O)C(=O)N3CCC(CC3)C4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=C(C=C(N1)C2=CC=CC=C2)C(=O)C(=O)N3CCC(CC3)C4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C26H26N2O4/c1-17-22(16-23(27-17)19-7-4-3-5-8-19)24(29)25(30)28-13-11-18(12-14-28)20-9-6-10-21(15-20)26(31)32-2/h3-10,15-16,18,27H,11-14H2,1-2H3