(5aS,11R,11aR)-11-(bromomethyl)-11a-naphthalen-2-yl-5a,6,11,12-tetrahydro-5H-tetracene

Systemtic Name: (5aS,11R,11aR)-11-(bromomethyl)-11a-naphthalen-2-yl-5a,6,11,12-tetrahydro-5H-tetracene Openeye Name: (5aS,11R,11aR)-11-(bromomethyl)-11a-(2-naphthyl)-5a,6,11,12-tetrahydro-5H-tetracene CAS Name: (5aS,11R,11aR)-11-(bromomethyl)-11a-(2-naphthalenyl)-5a,6,11,12-tetrahydro-5H-tetracene IUPAC Name: (5aS,11R,11aR)-11-(bromomethyl)-11a-naphthalen-2-yl-5a,6,11,12-tetrahydro-5H-tetracene Traditional Name: (5aS,11R,11aR)-11-(bromomethyl)-11a-(2-naphthyl)-5a,6,11,12-tetrahydro-5H-tetracene Formula: C29H25Br MolecularWeight: 453.4128

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3=CC=CC=C3C(C2(CC4=CC=CC=C41)C5=CC6=CC=CC=C6C=C5)CBr

Isomeric SMILES

C1[C@H]2CC3=CC=CC=C3[C@H]([C@]2(CC4=CC=CC=C41)C5=CC6=CC=CC=C6C=C5)CBr

InChI

InChI=1S/C29H25Br/c30-19-28-27-12-6-5-10-23(27)17-26-16-22-9-3-4-11-24(22)18-29(26,28)25-14-13-20-7-1-2-8-21(20)15-25/h1-15,26,28H,16-19H2/t26-,28+,29+/m0/s1