4-chloranyl-N-[4-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[4-(naphthalene-2-carbonyl)piperazin-1-yl]phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-[4-(naphthalene-2-carbonyl)piperazin-1-yl]phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-[4-(2-naphthoyl)piperazino]phenyl]-3-nitro-benzamide Formula: C28H23ClN4O4 MolecularWeight: 514.95962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H23ClN4O4/c29-25-12-7-21(18-26(25)33(36)37)27(34)30-23-8-10-24(11-9-23)31-13-15-32(16-14-31)28(35)22-6-5-19-3-1-2-4-20(19)17-22/h1-12,17-18H,13-16H2,(H,30,34)