3-[(6-methyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxymethyl]benzoate

Systemtic Name: 3-[(6-methyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxymethyl]benzoate Openeye Name: 3-[(6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxymethyl]benzoate CAS Name: 3-[(6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl)oxymethyl]benzoate IUPAC Name: 3-[(6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxymethyl]benzoate Traditional Name: 3-[(4-keto-6-methyl-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxymethyl]benzoate Formula: C21H17O5- MolecularWeight: 349.35668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)OCC4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)OCC4=CC=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C21H18O5/c1-12-18(25-11-13-4-2-5-14(10-13)20(22)23)9-8-16-15-6-3-7-17(15)21(24)26-19(12)16/h2,4-5,8-10H,3,6-7,11H2,1H3,(H,22,23)/p-1