[(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,3-benzodiazepin-1-yl)-phenyl-methyl]-ethyl-carbamic acid

Systemtic Name: [(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,3-benzodiazepin-1-yl)-phenyl-methyl]-ethyl-carbamic acid Openeye Name: [(7-chloro-2-oxo-5-phenyl-3H-1,3-benzodiazepin-1-yl)-phenyl-methyl]-ethyl-carbamic acid CAS Name: [(7-chloro-2-oxo-5-phenyl-3H-1,3-benzodiazepin-1-yl)-phenylmethyl]-ethylcarbamic acid IUPAC Name: [(7-chloro-2-oxo-5-phenyl-3H-1,3-benzodiazepin-1-yl)-phenylmethyl]-ethylcarbamic acid Traditional Name: [(7-chloro-2-keto-5-phenyl-3H-1,3-benzodiazepin-1-yl)-phenyl-methyl]-ethyl-carbamic acid Formula: C25H22ClN3O3 MolecularWeight: 447.91348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C1=CC=CC=C1)N2C3=C(C=C(C=C3)Cl)C(=CNC2=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCN(C(C1=CC=CC=C1)N2C3=C(C=C(C=C3)Cl)C(=CNC2=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H22ClN3O3/c1-2-28(25(31)32)23(18-11-7-4-8-12-18)29-22-14-13-19(26)15-20(22)21(16-27-24(29)30)17-9-5-3-6-10-17/h3-16,23H,2H2,1H3,(H,27,30)(H,31,32)