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

Systemtic Name: N-[1-[2-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[2-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-4-piperidyl]benzamide CAS Name: N-[1-[2-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-oxoethyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[2-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[2-(1-benzyl-2,5-dimethyl-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(N1CC2=CC=CC=C2)C)C(=O)CN3CCC(CC3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)CN3CCC(CC3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-20-17-25(21(2)30(20)18-22-9-5-3-6-10-22)26(31)19-29-15-13-24(14-16-29)28-27(32)23-11-7-4-8-12-23/h3-12,17,24H,13-16,18-19H2,1-2H3,(H,28,32)