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

Systemtic Name: N-[3-(phenethylcarbamoyl)-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(phenethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[oxo-(phenethylamino)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(phenethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(phenethylcarbamoyl)phenyl]-piperonylamide Formula: C35H35N3O4 MolecularWeight: 561.6701

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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)NCCC6=CC=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)NCCC6=CC=CC=C6

InChI

InChI=1S/C35H35N3O4/c39-34(28-11-14-32-33(22-28)42-24-41-32)37-29-12-13-31(30(23-29)35(40)36-18-15-25-7-3-1-4-8-25)38-19-16-27(17-20-38)21-26-9-5-2-6-10-26/h1-14,22-23,27H,15-21,24H2,(H,36,40)(H,37,39)