methyl 4-[2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-keto-6-nitro-1,3-benzoxazol-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C17H13N3O7 MolecularWeight: 371.30102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C17H13N3O7/c1-26-16(22)10-2-4-11(5-3-10)18-15(21)9-19-13-7-6-12(20(24)25)8-14(13)27-17(19)23/h2-8H,9H2,1H3,(H,18,21)