methyl 4-(1,2-dihydroaceanthrylen-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(1,2-dihydroaceanthrylen-3-yl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(1,2-dihydroaceanthrylen-3-yl)-4-oxo-butanoate CAS Name: 4-(1,2-dihydroaceanthrylen-3-yl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(1,2-dihydroaceanthrylen-3-yl)-4-oxobutanoate Traditional Name: 4-aceanthren-3-yl-4-keto-butyric acid methyl ester Formula: C21H18O3 MolecularWeight: 318.36582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)C1=C2CCC3=C2C(=CC4=CC=CC=C34)C=C1

Isomeric SMILES

COC(=O)CCC(=O)C1=C2CCC3=C2C(=CC4=CC=CC=C34)C=C1

InChI

InChI=1S/C21H18O3/c1-24-20(23)11-10-19(22)16-7-6-14-12-13-4-2-3-5-15(13)17-8-9-18(16)21(14)17/h2-7,12H,8-11H2,1H3