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

Systemtic Name: propan-2-yl 4-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]benzoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5/c1-14(2)28-21(26)15-7-9-16(10-8-15)22-19(24)13-23-17-5-3-4-6-18(17)27-12-11-20(23)25/h3-10,14H,11-13H2,1-2H3,(H,22,24)