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4-(azepan-1-yl)-N-[4-(methylcarbamoyl)phenyl]-3-nitro-benzamide

4-(azepan-1-yl)-N-[4-(methylcarbamoyl)phenyl]-3-nitro-benzamide

Systemtic Name:4-(azepan-1-yl)-N-[4-(methylcarbamoyl)phenyl]-3-nitro-benzamide
Openeye Name:4-(azepan-1-yl)-N-[4-(methylcarbamoyl)phenyl]-3-nitro-benzamide
CAS Name:4-(1-azepanyl)-N-[4-(methylcarbamoyl)phenyl]-3-nitrobenzamide
IUPAC Name:4-(azepan-1-yl)-N-[4-(methylcarbamoyl)phenyl]-3-nitrobenzamide
Traditional Name:4-(azepan-1-yl)-N-[4-(methylcarbamoyl)phenyl]-3-nitro-benzamide
Formula: C21H24N4O4
MolecularWeight: 396.43966
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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]


Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]


InChI

InChI=1S/C21H24N4O4/c1-22-20(26)15-6-9-17(10-7-15)23-21(27)16-8-11-18(19(14-16)25(28)29)24-12-4-2-3-5-13-24/h6-11,14H,2-5,12-13H2,1H3,(H,22,26)(H,23,27)


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