N-(1,3-benzodioxol-5-ylmethyl)-4-(4-chlorophenyl)carbonyl-piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-chlorophenyl)carbonyl-piperazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-chlorobenzoyl)piperazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chlorophenyl)-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-chlorobenzoyl)piperazine-1-carboxamide Traditional Name: 4-(4-chlorobenzoyl)-N-piperonyl-piperazine-1-carboxamide Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)Cl)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20ClN3O4/c21-16-4-2-15(3-5-16)19(25)23-7-9-24(10-8-23)20(26)22-12-14-1-6-17-18(11-14)28-13-27-17/h1-6,11H,7-10,12-13H2,(H,22,26)