5-bromanyl-2,3,4-tricyclohexyl-benzo[a]anthracene

Systemtic Name: 5-bromanyl-2,3,4-tricyclohexyl-benzo[a]anthracene Openeye Name: 5-bromo-2,3,4-tricyclohexyl-benzo[a]anthracene CAS Name: 5-bromo-2,3,4-tricyclohexylbenzo[a]anthracene IUPAC Name: 5-bromo-2,3,4-tricyclohexylbenzo[a]anthracene Traditional Name: 5-bromo-2,3,4-tricyclohexyl-benz[a]anthracene Formula: C36H41Br MolecularWeight: 553.61474

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C(=C3C(=C2)C4=CC5=CC=CC=C5C=C4C=C3Br)C6CCCCC6)C7CCCCC7

Isomeric SMILES

C1CCC(CC1)C2=C(C(=C3C(=C2)C4=CC5=CC=CC=C5C=C4C=C3Br)C6CCCCC6)C7CCCCC7

InChI

InChI=1S/C36H41Br/c37-33-22-29-20-27-18-10-11-19-28(27)21-30(29)32-23-31(24-12-4-1-5-13-24)34(25-14-6-2-7-15-25)35(36(32)33)26-16-8-3-9-17-26/h10-11,18-26H,1-9,12-17H2