2-[2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanoyloxyamino]-3-piperidin-4-yloxy-propanoic acid

Systemtic Name: 2-[2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanoyloxyamino]-3-piperidin-4-yloxy-propanoic acid Openeye Name: 2-[[2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]oxyamino]-3-(4-piperidyloxy)propanoic acid CAS Name: 2-[[1-oxo-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)ethoxy]amino]-3-(4-piperidinyloxy)propanoic acid IUPAC Name: 2-[[2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]oxyamino]-3-piperidin-4-yloxypropanoic acid Traditional Name: 2-[[2-(2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]oxyamino]-3-(4-piperidyloxy)propionic acid Formula: C20H27N3O6 MolecularWeight: 405.44488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1)CC(=O)ONC(COC3CCNCC3)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1)CC(=O)ONC(COC3CCNCC3)C(=O)O

InChI

InChI=1S/C20H27N3O6/c24-18-7-3-5-14-4-1-2-6-17(14)23(18)12-19(25)29-22-16(20(26)27)13-28-15-8-10-21-11-9-15/h1-2,4,6,15-16,21-22H,3,5,7-13H2,(H,26,27)