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

Systemtic Name: 2-[3-(2,2-dimethylpropanoylamino)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-(2,2-dimethylpropanoylamino)-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[3-[(2,2-dimethyl-1-oxopropyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[3-(2,2-dimethylpropanoylamino)-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[2-keto-3-(pivaloylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1CCC2=CC=CC=C2N(C1=O)CC(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1CCC2=CC=CC=C2N(C1=O)CC(=O)O

InChI

InChI=1S/C17H22N2O4/c1-17(2,3)16(23)18-12-9-8-11-6-4-5-7-13(11)19(15(12)22)10-14(20)21/h4-7,12H,8-10H2,1-3H3,(H,18,23)(H,20,21)