1-[(4-nitrophenyl)methyl]-1,2,4,5-tetrahydro-2-benzazepin-3-one

Systemtic Name: 1-[(4-nitrophenyl)methyl]-1,2,4,5-tetrahydro-2-benzazepin-3-one Openeye Name: 1-[(4-nitrophenyl)methyl]-1,2,4,5-tetrahydro-2-benzazepin-3-one CAS Name: 1-[(4-nitrophenyl)methyl]-1,2,4,5-tetrahydro-2-benzazepin-3-one IUPAC Name: 1-[(4-nitrophenyl)methyl]-1,2,4,5-tetrahydro-2-benzazepin-3-one Traditional Name: 1-(4-nitrobenzyl)-1,2,4,5-tetrahydro-2-benzazepin-3-one Formula: C17H16N2O3 MolecularWeight: 296.32054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(C2=CC=CC=C21)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)NC(C2=CC=CC=C21)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O3/c20-17-10-7-13-3-1-2-4-15(13)16(18-17)11-12-5-8-14(9-6-12)19(21)22/h1-6,8-9,16H,7,10-11H2,(H,18,20)