ethyl 3-[(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H17N3O7 MolecularWeight: 399.35418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O7/c1-3-28-19(25)12-6-11(7-14(8-12)22(26)27)18(24)20-13-4-5-16-15(9-13)21-17(23)10(2)29-16/h4-10H,3H2,1-2H3,(H,20,24)(H,21,23)