(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl) N-(hydroxymethyl)carbamate

Systemtic Name: (7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl) N-(hydroxymethyl)carbamate Openeye Name: (7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) N-(hydroxymethyl)carbamate CAS Name: N-(hydroxymethyl)carbamic acid (7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) ester IUPAC Name: (7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) N-(hydroxymethyl)carbamate Traditional Name: N-methylolcarbamic acid (7-chloro-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl) ester Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OC(=O)NCO)C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OC(=O)NCO)C3=CC=CC=C3

InChI

InChI=1S/C18H16ClN3O4/c1-22-14-8-7-12(19)9-13(14)15(11-5-3-2-4-6-11)21-16(17(22)24)26-18(25)20-10-23/h2-9,16,23H,10H2,1H3,(H,20,25)