ethyl benzo[a]pyrene-10-carboxylate

Systemtic Name: ethyl benzo[a]pyrene-10-carboxylate Openeye Name: ethyl benzo[a]pyrene-10-carboxylate CAS Name: 10-benzo[a]pyrenecarboxylic acid ethyl ester IUPAC Name: ethyl benzo[a]pyrene-10-carboxylate Traditional Name: benzo[a]pyrene-10-carboxylic acid ethyl ester Formula: C23H16O2 MolecularWeight: 324.37194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC2=CC3=C4C(=C21)C=CC5=CC=CC(=C54)C=C3

Isomeric SMILES

CCOC(=O)C1=CC=CC2=CC3=C4C(=C21)C=CC5=CC=CC(=C54)C=C3

InChI

InChI=1S/C23H16O2/c1-2-25-23(24)19-8-4-7-16-13-17-10-9-14-5-3-6-15-11-12-18(21(16)19)22(17)20(14)15/h3-13H,2H2,1H3