1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonyl-N-methyl-piperidine-4-carboxamide Openeye Name: 1-(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)-N-methyl-piperidine-4-carboxamide CAS Name: 1-[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-oxomethyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(1-benzyl-2,5-dimethylpyrrole-3-carbonyl)-N-methylpiperidine-4-carboxamide Traditional Name: 1-(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)-N-methyl-isonipecotamide Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)N3CCC(CC3)C(=O)NC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)N3CCC(CC3)C(=O)NC

InChI

InChI=1S/C21H27N3O2/c1-15-13-19(16(2)24(15)14-17-7-5-4-6-8-17)21(26)23-11-9-18(10-12-23)20(25)22-3/h4-8,13,18H,9-12,14H2,1-3H3,(H,22,25)