1-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethylcarbamic acid

Systemtic Name: 1-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethylcarbamic acid Openeye Name: 1-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethylcarbamic acid CAS Name: 1-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethylcarbamic acid IUPAC Name: 1-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethylcarbamic acid Traditional Name: 1-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethylcarbamic acid Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)O)N1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(NC(=O)O)N1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H16ClN3O3/c1-11(21-18(24)25)22-15-8-7-13(19)9-14(15)17(20-10-16(22)23)12-5-3-2-4-6-12/h2-9,11,21H,10H2,1H3,(H,24,25)