methyl 2-[7-[(4-cyanophenyl)carbonylamino]-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: methyl 2-[7-[(4-cyanophenyl)carbonylamino]-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoate Openeye Name: methyl 2-[7-[(4-cyanobenzoyl)amino]-2,4-dimethyl-3-oxo-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[7-[[(4-cyanophenyl)-oxomethyl]amino]-2,4-dimethyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-[(4-cyanobenzoyl)amino]-2,4-dimethyl-3-oxo-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[7-[(4-cyanobenzoyl)amino]-3-keto-2,4-dimethyl-1,4-benzoxazin-2-yl]acetic acid methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C#N)C)CC(=O)OC

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C#N)C)CC(=O)OC

InChI

InChI=1S/C21H19N3O5/c1-21(11-18(25)28-3)20(27)24(2)16-9-8-15(10-17(16)29-21)23-19(26)14-6-4-13(12-22)5-7-14/h4-10H,11H2,1-3H3,(H,23,26)