(4-methyl-1,4-diazepan-1-yl)-(4-methyl-3-nitro-phenyl)methanone

Systemtic Name: (4-methyl-1,4-diazepan-1-yl)-(4-methyl-3-nitro-phenyl)methanone Openeye Name: (4-methyl-1,4-diazepan-1-yl)-(4-methyl-3-nitro-phenyl)methanone CAS Name: (4-methyl-1,4-diazepan-1-yl)-(4-methyl-3-nitrophenyl)methanone IUPAC Name: (4-methyl-1,4-diazepan-1-yl)-(4-methyl-3-nitrophenyl)methanone Traditional Name: (4-methyl-1,4-diazepan-1-yl)-(4-methyl-3-nitro-phenyl)methanone Formula: C14H19N3O3 MolecularWeight: 277.31896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O3/c1-11-4-5-12(10-13(11)17(19)20)14(18)16-7-3-6-15(2)8-9-16/h4-5,10H,3,6-9H2,1-2H3