7-methyl-9,10-dihydro-8H-benzo[a]pyrene-7,8-diol

Systemtic Name: 7-methyl-9,10-dihydro-8H-benzo[a]pyrene-7,8-diol Openeye Name: 7-methyl-9,10-dihydro-8H-benzo[a]pyrene-7,8-diol CAS Name: 7-methyl-9,10-dihydro-8H-benzo[a]pyrene-7,8-diol IUPAC Name: 7-methyl-9,10-dihydro-8H-benzo[a]pyrene-7,8-diol Traditional Name: 7-methyl-9,10-dihydro-8H-benzo[a]pyrene-7,8-diol Formula: C21H18O2 MolecularWeight: 302.36642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4)O)O

Isomeric SMILES

CC1(C(CCC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4)O)O

InChI

InChI=1S/C21H18O2/c1-21(23)17-11-14-6-5-12-3-2-4-13-7-8-16(20(14)19(12)13)15(17)9-10-18(21)22/h2-8,11,18,22-23H,9-10H2,1H3