2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoyloxyamino]-8-piperidin-1-yl-octanoic acid

Systemtic Name: 2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoyloxyamino]-8-piperidin-1-yl-octanoic acid Openeye Name: 2-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]oxyamino]-8-(1-piperidyl)octanoic acid CAS Name: 2-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)ethoxy]amino]-8-(1-piperidinyl)octanoic acid IUPAC Name: 2-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]oxyamino]-8-piperidin-1-yloctanoic acid Traditional Name: 2-[[2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]oxyamino]-8-piperidino-caprylic acid Formula: C24H35N3O6 MolecularWeight: 461.5512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCCC(C(=O)O)NOC(=O)CN2C(=O)CCOC3=CC=CC=C32

Isomeric SMILES

C1CCN(CC1)CCCCCCC(C(=O)O)NOC(=O)CN2C(=O)CCOC3=CC=CC=C32

InChI

InChI=1S/C24H35N3O6/c28-22-13-17-32-21-12-6-5-11-20(21)27(22)18-23(29)33-25-19(24(30)31)10-4-1-2-7-14-26-15-8-3-9-16-26/h5-6,11-12,19,25H,1-4,7-10,13-18H2,(H,30,31)