3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-8-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-8-carboxylic acid Openeye Name: 3-(tert-butoxycarbonylamino)-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-8-carboxylic acid CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-8-carboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-8-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-2-keto-1,3,4,5-tetrahydro-1-benzazepine-8-carboxylic acid Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC2=C(C=C(C=C2)C(=O)O)NC1=O

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC2=C(C=C(C=C2)C(=O)O)NC1=O

InChI

InChI=1S/C16H20N2O5/c1-16(2,3)23-15(22)18-11-7-6-9-4-5-10(14(20)21)8-12(9)17-13(11)19/h4-5,8,11H,6-7H2,1-3H3,(H,17,19)(H,18,22)(H,20,21)