tert-butyl N-(5-chloranyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate

Systemtic Name: tert-butyl N-(5-chloranyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Openeye Name: tert-butyl N-(5-chloro-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(5-chloro-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(5-chloro-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(5-chloro-2-keto-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid tert-butyl ester Formula: C14H16ClN3O3 MolecularWeight: 309.74814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1C(=O)N=C2C=CC=CC2=C(N1)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1C(=O)N=C2C=CC=CC2=C(N1)Cl

InChI

InChI=1S/C14H16ClN3O3/c1-14(2,3)21-13(20)18-11-12(19)16-9-7-5-4-6-8(9)10(15)17-11/h4-7,11,17H,1-3H3,(H,18,20)