(2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl 3-nitrobenzoate

Systemtic Name: (2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl 3-nitrobenzoate Openeye Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (2-oxo-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-4-yl)methyl ester IUPAC Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-keto-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl ester Formula: C20H15NO6 MolecularWeight: 365.3362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)COC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)COC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15NO6/c22-19-10-15(17-8-12-3-1-4-13(12)9-18(17)27-19)11-26-20(23)14-5-2-6-16(7-14)21(24)25/h2,5-10H,1,3-4,11H2