methyl 4-[(7-acetamido-2-oxidanylidene-chromen-4-yl)methoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[(7-acetamido-2-oxidanylidene-chromen-4-yl)methoxy]-3-nitro-benzoate Openeye Name: methyl 4-[(7-acetamido-2-oxo-chromen-4-yl)methoxy]-3-nitro-benzoate CAS Name: 4-[(7-acetamido-2-oxo-1-benzopyran-4-yl)methoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(7-acetamido-2-oxochromen-4-yl)methoxy]-3-nitrobenzoate Traditional Name: 4-[(7-acetamido-2-keto-chromen-4-yl)methoxy]-3-nitro-benzoic acid methyl ester Formula: C20H16N2O8 MolecularWeight: 412.34964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O8/c1-11(23)21-14-4-5-15-13(8-19(24)30-18(15)9-14)10-29-17-6-3-12(20(25)28-2)7-16(17)22(26)27/h3-9H,10H2,1-2H3,(H,21,23)