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

Systemtic Name: 1-[2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrol-3-yl]carbonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[1-(4-isopropylphenyl)-2,5-dimethyl-pyrrole-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2,5-dimethyl-1-(4-propan-2-ylphenyl)-3-pyrrolyl]-oxomethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2,5-dimethyl-1-(4-propan-2-ylphenyl)pyrrole-3-carbonyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-(2,5-dimethyl-1-p-cumenyl-pyrrole-3-carbonyl)isonipecotamide Formula: C29H35N3O2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)C)C)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)C)C)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O2/c1-20(2)24-10-12-26(13-11-24)32-21(3)18-27(22(32)4)29(34)31-16-14-25(15-17-31)28(33)30-19-23-8-6-5-7-9-23/h5-13,18,20,25H,14-17,19H2,1-4H3,(H,30,33)