4-(azepan-1-yl)-3-nitro-N-propan-2-yl-benzamide

Systemtic Name: 4-(azepan-1-yl)-3-nitro-N-propan-2-yl-benzamide Openeye Name: 4-(azepan-1-yl)-N-isopropyl-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-3-nitro-N-propan-2-ylbenzamide IUPAC Name: 4-(azepan-1-yl)-3-nitro-N-propan-2-ylbenzamide Traditional Name: 4-(azepan-1-yl)-N-isopropyl-3-nitro-benzamide Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3/c1-12(2)17-16(20)13-7-8-14(15(11-13)19(21)22)18-9-5-3-4-6-10-18/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,20)