2-chloranyl-4-nitro-N-[2-[3-(2-oxidanylideneazepan-1-yl)propylcarbamoyl]phenyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[2-[3-(2-oxidanylideneazepan-1-yl)propylcarbamoyl]phenyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[2-[3-(2-oxoazepan-1-yl)propylcarbamoyl]phenyl]benzamide CAS Name: 2-chloro-4-nitro-N-[2-[oxo-[3-(2-oxo-1-azepanyl)propylamino]methyl]phenyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[2-[3-(2-oxoazepan-1-yl)propylcarbamoyl]phenyl]benzamide Traditional Name: 2-chloro-N-[2-[3-(2-ketoazepan-1-yl)propylcarbamoyl]phenyl]-4-nitro-benzamide Formula: C23H25ClN4O5 MolecularWeight: 472.9214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H25ClN4O5/c24-19-15-16(28(32)33)10-11-17(19)23(31)26-20-8-4-3-7-18(20)22(30)25-12-6-14-27-13-5-1-2-9-21(27)29/h3-4,7-8,10-11,15H,1-2,5-6,9,12-14H2,(H,25,30)(H,26,31)