methyl 4-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methoxy]-3-nitro-benzoate Openeye Name: methyl 4-[(7,8-dimethyl-2-oxo-chromen-4-yl)methoxy]-3-nitro-benzoate CAS Name: 4-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(7,8-dimethyl-2-oxochromen-4-yl)methoxy]-3-nitrobenzoate Traditional Name: 4-[(2-keto-7,8-dimethyl-chromen-4-yl)methoxy]-3-nitro-benzoic acid methyl ester Formula: C20H17NO7 MolecularWeight: 383.35148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H17NO7/c1-11-4-6-15-14(9-18(22)28-19(15)12(11)2)10-27-17-7-5-13(20(23)26-3)8-16(17)21(24)25/h4-9H,10H2,1-3H3