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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3-methylphenyl)-1-(phenylmethyl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-(m-tolyl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3-methylphenyl)-1-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-(3-methylphenyl)piperidine-3-carboxamide Traditional Name: 1-benzyl-5-(m-tolyl)-N-piperonyl-nipecotamide Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CC(CN(C2)CC3=CC=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC(=C1)C2CC(CN(C2)CC3=CC=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H30N2O3/c1-20-6-5-9-23(12-20)24-14-25(18-30(17-24)16-21-7-3-2-4-8-21)28(31)29-15-22-10-11-26-27(13-22)33-19-32-26/h2-13,24-25H,14-19H2,1H3,(H,29,31)