4-(4-naphthalen-1-ylcarbonylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: 4-(4-naphthalen-1-ylcarbonylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: 4-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-3-nitro-benzamide CAS Name: 4-[4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-(1-naphthoyl)piperazino]-3-nitro-benzamide Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N4O4/c23-21(27)16-8-9-19(20(14-16)26(29)30)24-10-12-25(13-11-24)22(28)18-7-3-5-15-4-1-2-6-17(15)18/h1-9,14H,10-13H2,(H2,23,27)