(4-methyl-1,4-diazepan-1-yl)-(2-nitrophenyl)methanone

Systemtic Name: (4-methyl-1,4-diazepan-1-yl)-(2-nitrophenyl)methanone Openeye Name: (4-methyl-1,4-diazepan-1-yl)-(2-nitrophenyl)methanone CAS Name: (4-methyl-1,4-diazepan-1-yl)-(2-nitrophenyl)methanone IUPAC Name: (4-methyl-1,4-diazepan-1-yl)-(2-nitrophenyl)methanone Traditional Name: (4-methyl-1,4-diazepan-1-yl)-(2-nitrophenyl)methanone Formula: C13H17N3O3 MolecularWeight: 263.29238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CN1CCCN(CC1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c1-14-7-4-8-15(10-9-14)13(17)11-5-2-3-6-12(11)16(18)19/h2-3,5-6H,4,7-10H2,1H3