7-chloranyl-1-(2-oxidanylidene-3-phenyl-propyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(2-oxidanylidene-3-phenyl-propyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(2-oxo-3-phenyl-propyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(2-oxo-3-phenylpropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(2-oxo-3-phenylpropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(2-keto-3-phenyl-propyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Formula: C27H25ClN2O2 MolecularWeight: 444.9526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)CC4=CC=CC=C4

Isomeric SMILES

CCCC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H25ClN2O2/c1-2-9-24-27(32)30(18-22(31)16-19-10-5-3-6-11-19)25-15-14-21(28)17-23(25)26(29-24)20-12-7-4-8-13-20/h3-8,10-15,17,24H,2,9,16,18H2,1H3