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

Systemtic Name: 2-[2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanoyloxyamino]-3-(3-piperidin-4-ylpropoxy)propanoic acid Openeye Name: 2-[[2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]oxyamino]-3-[3-(4-piperidyl)propoxy]propanoic acid CAS Name: 2-[[1-oxo-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)ethoxy]amino]-3-[3-(4-piperidinyl)propoxy]propanoic acid IUPAC Name: 2-[[2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]oxyamino]-3-(3-piperidin-4-ylpropoxy)propanoic acid Traditional Name: 2-[[2-(2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]oxyamino]-3-[3-(4-piperidyl)propoxy]propionic acid Formula: C23H33N3O6 MolecularWeight: 447.52462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1)CC(=O)ONC(COCCCC3CCNCC3)C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1)CC(=O)ONC(COCCCC3CCNCC3)C(=O)O

InChI

InChI=1S/C23H33N3O6/c27-21-9-3-7-18-6-1-2-8-20(18)26(21)15-22(28)32-25-19(23(29)30)16-31-14-4-5-17-10-12-24-13-11-17/h1-2,6,8,17,19,24-25H,3-5,7,9-16H2,(H,29,30)