[1-oxidanylidene-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propan-2-yl] 3-(ethoxycarbonylamino)benzoate

Systemtic Name: [1-oxidanylidene-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)propan-2-yl] 3-(ethoxycarbonylamino)benzoate Openeye Name: [1-methyl-2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] 3-(ethoxycarbonylamino)benzoate CAS Name: 3-(ethoxycarbonylamino)benzoic acid [1-oxo-1-(3-oxo-4H-1,4-benzoxazin-6-yl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-oxo-4H-1,4-benzoxazin-6-yl)propan-2-yl] 3-(ethoxycarbonylamino)benzoate Traditional Name: 3-(carbethoxyamino)benzoic acid [2-keto-2-(3-keto-4H-1,4-benzoxazin-6-yl)-1-methyl-ethyl] ester Formula: C21H20N2O7 MolecularWeight: 412.3927

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=CC(=C1)C(=O)OC(C)C(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CCOC(=O)NC1=CC=CC(=C1)C(=O)OC(C)C(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C21H20N2O7/c1-3-28-21(27)22-15-6-4-5-14(9-15)20(26)30-12(2)19(25)13-7-8-17-16(10-13)23-18(24)11-29-17/h4-10,12H,3,11H2,1-2H3,(H,22,27)(H,23,24)