(7R)-7-methyl-8H-benzo[a]pyrene-7,8-diol

Systemtic Name: (7R)-7-methyl-8H-benzo[a]pyrene-7,8-diol Openeye Name: (7R)-7-methyl-8H-benzo[a]pyrene-7,8-diol CAS Name: (7R)-7-methyl-8H-benzo[a]pyrene-7,8-diol IUPAC Name: (7R)-7-methyl-8H-benzo[a]pyrene-7,8-diol Traditional Name: (7R)-7-methyl-8H-benzo[a]pyrene-7,8-diol Formula: C21H16O2 MolecularWeight: 300.35054

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C=CC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4)O)O

Isomeric SMILES

C[C@@]1(C(C=CC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4)O)O

InChI

InChI=1S/C21H16O2/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/h2-11,18,22-23H,1H3/t18?,21-/m1/s1