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

Systemtic Name: 2-[1-(2-azanyloxy-2-oxidanylidene-ethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]-3-(3-piperidin-4-ylpropoxy)propanoic acid Openeye Name: 2-[1-(2-aminooxy-2-oxo-ethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]-3-[3-(4-piperidyl)propoxy]propanoic acid CAS Name: 2-[1-(2-aminooxy-2-oxoethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]-3-[3-(4-piperidinyl)propoxy]propanoic acid IUPAC Name: 2-[1-(2-aminooxy-2-oxoethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]-3-(3-piperidin-4-ylpropoxy)propanoic acid Traditional Name: 2-[1-(2-aminooxy-2-keto-ethyl)-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]-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)C1C(COCCCC3CCNCC3)C(=O)O)CC(=O)ON

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1C(COCCCC3CCNCC3)C(=O)O)CC(=O)ON

InChI

InChI=1S/C23H33N3O6/c24-32-21(27)14-26-20-6-2-1-5-17(20)7-8-18(22(26)28)19(23(29)30)15-31-13-3-4-16-9-11-25-12-10-16/h1-2,5-6,16,18-19,25H,3-4,7-15,24H2,(H,29,30)