4-(azepan-1-yl)-N-hexyl-3-nitro-benzamide

Systemtic Name: 4-(azepan-1-yl)-N-hexyl-3-nitro-benzamide Openeye Name: 4-(azepan-1-yl)-N-hexyl-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-N-hexyl-3-nitrobenzamide IUPAC Name: 4-(azepan-1-yl)-N-hexyl-3-nitrobenzamide Traditional Name: 4-(azepan-1-yl)-N-hexyl-3-nitro-benzamide Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC(=C(C=C1)N2CCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCNC(=O)C1=CC(=C(C=C1)N2CCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C19H29N3O3/c1-2-3-4-7-12-20-19(23)16-10-11-17(18(15-16)22(24)25)21-13-8-5-6-9-14-21/h10-11,15H,2-9,12-14H2,1H3,(H,20,23)