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

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)-3-[(phenylmethyl)carbamoyl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(benzylcarbamoyl)-4-(4-methyl-1-piperidyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(4-methyl-1-piperidinyl)-3-[oxo-[(phenylmethyl)amino]methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(benzylcarbamoyl)-4-(4-methylpiperidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(benzylcarbamoyl)-4-(4-methylpiperidino)phenyl]-piperonylamide Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O4/c1-19-11-13-31(14-12-19)24-9-8-22(16-23(24)28(33)29-17-20-5-3-2-4-6-20)30-27(32)21-7-10-25-26(15-21)35-18-34-25/h2-10,15-16,19H,11-14,17-18H2,1H3,(H,29,33)(H,30,32)