4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-benzamide Openeye Name: 4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitro-benzamide CAS Name: 4-[4-(2-hydroxyphenyl)-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-(2-hydroxyphenyl)piperazino]-3-nitro-benzamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C3=CC=CC=C3O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C3=CC=CC=C3O

InChI

InChI=1S/C17H18N4O4/c18-17(23)12-5-6-13(15(11-12)21(24)25)19-7-9-20(10-8-19)14-3-1-2-4-16(14)22/h1-6,11,22H,7-10H2,(H2,18,23)