N-[4-[4-(phenylmethyl)piperidin-1-yl]-3-(pyridin-3-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperidin-1-yl]-3-(pyridin-3-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(3-pyridylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[oxo-(3-pyridinylmethylamino)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(pyridin-3-ylmethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(3-pyridylmethylcarbamoyl)phenyl]-piperonylamide Formula: C33H32N4O4 MolecularWeight: 548.63158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5)C(=O)NCC6=CN=CC=C6

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5)C(=O)NCC6=CN=CC=C6

InChI

InChI=1S/C33H32N4O4/c38-32(26-8-11-30-31(18-26)41-22-40-30)36-27-9-10-29(28(19-27)33(39)35-21-25-7-4-14-34-20-25)37-15-12-24(13-16-37)17-23-5-2-1-3-6-23/h1-11,14,18-20,24H,12-13,15-17,21-22H2,(H,35,39)(H,36,38)