N-(azepan-1-yl)-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-(azepan-1-yl)-2-chloranyl-5-nitro-benzamide Openeye Name: N-(azepan-1-yl)-2-chloro-5-nitro-benzamide CAS Name: N-(1-azepanyl)-2-chloro-5-nitrobenzamide IUPAC Name: N-(azepan-1-yl)-2-chloro-5-nitrobenzamide Traditional Name: N-(azepan-1-yl)-2-chloro-5-nitro-benzamide Formula: C13H16ClN3O3 MolecularWeight: 297.73744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCCN(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H16ClN3O3/c14-12-6-5-10(17(19)20)9-11(12)13(18)15-16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8H2,(H,15,18)