N-[3-(azepan-1-yl)propyl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-chloro-5-nitro-benzamide CAS Name: N-[3-(1-azepanyl)propyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-chloro-5-nitrobenzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-chloro-5-nitro-benzamide Formula: C16H22ClN3O3 MolecularWeight: 339.81718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22ClN3O3/c17-15-7-6-13(20(22)23)12-14(15)16(21)18-8-5-11-19-9-3-1-2-4-10-19/h6-7,12H,1-5,8-11H2,(H,18,21)