3,6-dimethyl-1,2-dihydrobenzo[j]aceanthrylene

Systemtic Name: 3,6-dimethyl-1,2-dihydrobenzo[j]aceanthrylene Openeye Name: 3,6-dimethyl-1,2-dihydrobenzo[j]aceanthrylene CAS Name: 3,6-dimethyl-1,2-dihydrobenzo[j]aceanthrylene IUPAC Name: 3,6-dimethyl-1,2-dihydrobenzo[j]aceanthrylene Traditional Name: 3,6-dimethylcholanthrene Formula: C22H18 MolecularWeight: 282.37832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC3=C2C(=C(C4=C3C=CC5=CC=CC=C54)C)C=C1

Isomeric SMILES

CC1=C2CCC3=C2C(=C(C4=C3C=CC5=CC=CC=C54)C)C=C1

InChI

InChI=1S/C22H18/c1-13-7-9-17-14(2)21-18-6-4-3-5-15(18)8-10-19(21)20-12-11-16(13)22(17)20/h3-10H,11-12H2,1-2H3