(12-methylbenzo[a]anthracen-7-yl) ethanoate

Systemtic Name: (12-methylbenzo[a]anthracen-7-yl) ethanoate Openeye Name: (12-methylbenzo[a]anthracen-7-yl) acetate CAS Name: acetic acid (12-methyl-7-benzo[a]anthracenyl) ester IUPAC Name: (12-methylbenzo[a]anthracen-7-yl) acetate Traditional Name: acetic acid (12-methylbenz[a]anthracen-7-yl) ester Formula: C21H16O2 MolecularWeight: 300.35054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C3=CC=CC=C13)OC(=O)C)C=CC4=CC=CC=C42

Isomeric SMILES

CC1=C2C(=C(C3=CC=CC=C13)OC(=O)C)C=CC4=CC=CC=C42

InChI

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