N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-piperonylamide Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C18H16ClN3O4/c19-13-8-12(2-3-14(13)22-6-5-20-17(23)9-22)21-18(24)11-1-4-15-16(7-11)26-10-25-15/h1-4,7-8H,5-6,9-10H2,(H,20,23)(H,21,24)