methyl chrysene-5-carboxylate

Systemtic Name: methyl chrysene-5-carboxylate Openeye Name: methyl chrysene-5-carboxylate CAS Name: 5-chrysenecarboxylic acid methyl ester IUPAC Name: methyl chrysene-5-carboxylate Traditional Name: chrysene-5-carboxylic acid methyl ester Formula: C20H14O2 MolecularWeight: 286.32396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H14O2/c1-22-20(21)18-12-14-7-3-4-8-15(14)17-11-10-13-6-2-5-9-16(13)19(17)18/h2-12H,1H3