butyl 4-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]benzoic acid butyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)CCOC3=CC=CC=C32

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)CCOC3=CC=CC=C32

InChI

InChI=1S/C22H24N2O5/c1-2-3-13-29-22(27)16-8-10-17(11-9-16)23-20(25)15-24-18-6-4-5-7-19(18)28-14-12-21(24)26/h4-11H,2-3,12-15H2,1H3,(H,23,25)