3-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: 3-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: 3-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 3-[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 3-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-N-phenylpiperidine-1-carboxamide Traditional Name: N-phenyl-3-[3-(piperonylcarbamoyl)phenyl]piperidine-1-carboxamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CN(C1)C(=O)NC2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H27N3O4/c31-26(28-16-19-11-12-24-25(14-19)34-18-33-24)21-7-4-6-20(15-21)22-8-5-13-30(17-22)27(32)29-23-9-2-1-3-10-23/h1-4,6-7,9-12,14-15,22H,5,8,13,16-18H2,(H,28,31)(H,29,32)