4-(1,3-benzodioxol-5-ylcarbonyl)-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylcarbonyl)-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: 4-(1,3-benzodioxole-5-carbonyl)-N-benzyl-piperazine-1-carboxamide CAS Name: 4-[1,3-benzodioxol-5-yl(oxo)methyl]-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: 4-(1,3-benzodioxole-5-carbonyl)-N-benzylpiperazine-1-carboxamide Traditional Name: N-benzyl-4-piperonyloyl-piperazine-1-carboxamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C20H21N3O4/c24-19(16-6-7-17-18(12-16)27-14-26-17)22-8-10-23(11-9-22)20(25)21-13-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,21,25)