2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-(tert-butoxycarbonylamino)-5-hydroxy-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[5-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[5-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[3-(tert-butoxycarbonylamino)-5-hydroxy-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC(C2=CC=CC=C2N(C1=O)CC(=O)O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1CC(C2=CC=CC=C2N(C1=O)CC(=O)O)O

InChI

InChI=1S/C17H22N2O6/c1-17(2,3)25-16(24)18-11-8-13(20)10-6-4-5-7-12(10)19(15(11)23)9-14(21)22/h4-7,11,13,20H,8-9H2,1-3H3,(H,18,24)(H,21,22)