azepan-1-yl-(3-methyl-2-nitro-phenyl)methanone

Systemtic Name: azepan-1-yl-(3-methyl-2-nitro-phenyl)methanone Openeye Name: azepan-1-yl-(3-methyl-2-nitro-phenyl)methanone CAS Name: 1-azepanyl-(3-methyl-2-nitrophenyl)methanone IUPAC Name: azepan-1-yl-(3-methyl-2-nitrophenyl)methanone Traditional Name: azepan-1-yl-(3-methyl-2-nitro-phenyl)methanone Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCCCCC2

InChI

InChI=1S/C14H18N2O3/c1-11-7-6-8-12(13(11)16(18)19)14(17)15-9-4-2-3-5-10-15/h6-8H,2-5,9-10H2,1H3