4-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxidanylidene-3,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxidanylidene-3,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid Openeye Name: 4-tert-butoxycarbonyl-2-oxo-3,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid CAS Name: 4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-oxo-3,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]-2-oxo-3,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid Traditional Name: 4-tert-butoxycarbonyl-2-keto-3,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2=C(C=C(C=C2)C(=O)O)NC(=O)C1

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2=C(C=C(C=C2)C(=O)O)NC(=O)C1

InChI

InChI=1S/C15H18N2O5/c1-15(2,3)22-14(21)17-7-10-5-4-9(13(19)20)6-11(10)16-12(18)8-17/h4-6H,7-8H2,1-3H3,(H,16,18)(H,19,20)