2-[(7-chloranyl-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: 2-[(7-chloranyl-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: 2-[(7-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carbonyl)amino]-3-hydroxy-propanoate CAS Name: 2-[[(7-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl)-oxomethyl]amino]-3-hydroxypropanoate IUPAC Name: 2-[(7-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carbonyl)amino]-3-hydroxypropanoate Traditional Name: 2-[(7-chloro-6-keto-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carbonyl)amino]-3-hydroxy-propionate Formula: C16H14ClN4O5- MolecularWeight: 377.75916

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(N=CN2C3=C(C1=O)C(=CC=C3)Cl)C(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

CN1CC2=C(N=CN2C3=C(C1=O)C(=CC=C3)Cl)C(=O)NC(CO)C(=O)[O-]

InChI

InChI=1S/C16H15ClN4O5/c1-20-5-11-13(14(23)19-9(6-22)16(25)26)18-7-21(11)10-4-2-3-8(17)12(10)15(20)24/h2-4,7,9,22H,5-6H2,1H3,(H,19,23)(H,25,26)/p-1