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

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 4-methoxy-3-nitro-benzoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (7-acetamido-2-keto-chromen-4-yl)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)COC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=C(C=C3)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)10-29-20(25)12-3-6-17(28-2)16(7-12)22(26)27/h3-9H,10H2,1-2H3,(H,21,23)