[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]-(3-nitrophenyl)methanone IUPAC Name: [4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]-(3-nitrophenyl)methanone Formula: C17H23N3O3 MolecularWeight: 317.38282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(=CCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H23N3O3/c1-14(2)7-10-18-8-4-9-19(12-11-18)17(21)15-5-3-6-16(13-15)20(22)23/h3,5-7,13H,4,8-12H2,1-2H3