7,12-dimethylbenzo[a]anthracene-5-carboxylic acid

Systemtic Name: 7,12-dimethylbenzo[a]anthracene-5-carboxylic acid Openeye Name: 7,12-dimethylbenzo[a]anthracene-5-carboxylic acid CAS Name: 7,12-dimethyl-5-benzo[a]anthracenecarboxylic acid IUPAC Name: 7,12-dimethylbenzo[a]anthracene-5-carboxylic acid Traditional Name: 7,12-dimethylbenz[a]anthracene-5-carboxylic acid Formula: C21H16O2 MolecularWeight: 300.35054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C3=CC=CC=C3C2=C(C4=CC=CC=C14)C)C(=O)O

Isomeric SMILES

CC1=C2C=C(C3=CC=CC=C3C2=C(C4=CC=CC=C14)C)C(=O)O

InChI

InChI=1S/C21H16O2/c1-12-14-7-3-4-8-15(14)13(2)20-17-10-6-5-9-16(17)19(21(22)23)11-18(12)20/h3-11H,1-2H3,(H,22,23)