N-[1-[2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[2-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-2-oxo-ethyl]-4-piperidyl]benzamide CAS Name: N-[1-[2-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-2-oxoethyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-oxoethyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[2-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-2-keto-ethyl]-4-piperidyl]benzamide Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CN3CCC(CC3)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)CN3CCC(CC3)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H31N3O2/c1-19-9-11-24(12-10-19)30-20(2)17-25(21(30)3)26(31)18-29-15-13-23(14-16-29)28-27(32)22-7-5-4-6-8-22/h4-12,17,23H,13-16,18H2,1-3H3,(H,28,32)