2-(carboxymethyl)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanylidene-2,5-dihydro-1,4-benzodiazepine-7-carboxylic acid

Systemtic Name: 2-(carboxymethyl)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanylidene-2,5-dihydro-1,4-benzodiazepine-7-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-2-(carboxymethyl)-4-methyl-3-oxo-2,5-dihydro-1,4-benzodiazepine-7-carboxylic acid CAS Name: 2-(carboxymethyl)-4-methyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-oxo-2,5-dihydro-1,4-benzodiazepine-7-carboxylic acid IUPAC Name: 2-(carboxymethyl)-4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-dihydro-1,4-benzodiazepine-7-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-2-(carboxymethyl)-3-keto-4-methyl-2,5-dihydro-1,4-benzodiazepine-7-carboxylic acid Formula: C18H22N2O7 MolecularWeight: 378.37648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(=O)N(CC2=C1C=CC(=C2)C(=O)O)C)CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C(C(=O)N(CC2=C1C=CC(=C2)C(=O)O)C)CC(=O)O

InChI

InChI=1S/C18H22N2O7/c1-18(2,3)27-17(26)20-12-6-5-10(16(24)25)7-11(12)9-19(4)15(23)13(20)8-14(21)22/h5-7,13H,8-9H2,1-4H3,(H,21,22)(H,24,25)