N-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentylcarbonyl-6-(3-methylphenyl)piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-cyclopentylcarbonyl-6-(3-methylphenyl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopentanecarbonyl)-6-(m-tolyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[cyclopentyl(oxo)methyl]-6-(3-methylphenyl)-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(cyclopentanecarbonyl)-6-(3-methylphenyl)piperidine-3-carboxamide Traditional Name: 1-(cyclopentanecarbonyl)-6-(m-tolyl)-N-piperonyl-nipecotamide Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCC(CN2C(=O)C3CCCC3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC(=C1)C2CCC(CN2C(=O)C3CCCC3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H32N2O4/c1-18-5-4-8-21(13-18)23-11-10-22(16-29(23)27(31)20-6-2-3-7-20)26(30)28-15-19-9-12-24-25(14-19)33-17-32-24/h4-5,8-9,12-14,20,22-23H,2-3,6-7,10-11,15-17H2,1H3,(H,28,30)