N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-nitro-benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-nitro-benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-nitrobenzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-3-nitro-benzamide Formula: C17H15ClN4O4 MolecularWeight: 374.7784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN4O4/c18-14-9-12(4-5-15(14)21-7-6-19-16(23)10-21)20-17(24)11-2-1-3-13(8-11)22(25)26/h1-5,8-9H,6-7,10H2,(H,19,23)(H,20,24)