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

Systemtic Name: butyl 4-[2-(2-oxidanylidene-3,4-dihydro-1,4-benzoxazin-3-yl)ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(2-oxo-3,4-dihydro-1,4-benzoxazin-3-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(2-oxo-3,4-dihydro-1,4-benzoxazin-3-yl)ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(2-oxo-3,4-dihydro-1,4-benzoxazin-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-keto-3,4-dihydro-1,4-benzoxazin-3-yl)acetyl]amino]benzoic acid butyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)OC3=CC=CC=C3N2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)OC3=CC=CC=C3N2

InChI

InChI=1S/C21H22N2O5/c1-2-3-12-27-20(25)14-8-10-15(11-9-14)22-19(24)13-17-21(26)28-18-7-5-4-6-16(18)23-17/h4-11,17,23H,2-3,12-13H2,1H3,(H,22,24)