[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: [1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: [2-(4-ethoxyanilino)-1-methyl-2-oxo-ethyl] 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzoxazin-4-yl)propanoic acid [1-(4-ethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethoxyanilino)-1-oxopropan-2-yl] 3-(3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)propionic acid [2-keto-1-methyl-2-(p-phenetidino)ethyl] ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C22H24N2O6/c1-3-28-17-10-8-16(9-11-17)23-22(27)15(2)30-21(26)12-13-24-18-6-4-5-7-19(18)29-14-20(24)25/h4-11,15H,3,12-14H2,1-2H3,(H,23,27)