1-[(3R,4R,11aS)-8-(4-fluorophenyl)-11a-methyl-3-(trifluoromethyl)-3,4,4a,5,6,11-hexahydro-2H-naphtho[1,2-f]indazol-4-yl]-N-(phenylmethyl)methanamine

Systemtic Name: 1-[(3R,4R,11aS)-8-(4-fluorophenyl)-11a-methyl-3-(trifluoromethyl)-3,4,4a,5,6,11-hexahydro-2H-naphtho[1,2-f]indazol-4-yl]-N-(phenylmethyl)methanamine Openeye Name: 1-[(3R,4R,11aS)-8-(4-fluorophenyl)-11a-methyl-3-(trifluoromethyl)-3,4,4a,5,6,11-hexahydro-2H-naphtho[1,2-f]indazol-4-yl]-N-benzyl-methanamine CAS Name: 1-[(3R,4R,11aS)-8-(4-fluorophenyl)-11a-methyl-3-(trifluoromethyl)-3,4,4a,5,6,11-hexahydro-2H-naphtho[1,2-f]indazol-4-yl]-N-(phenylmethyl)methanamine IUPAC Name: 1-[(3R,4R,11aS)-8-(4-fluorophenyl)-11a-methyl-3-(trifluoromethyl)-3,4,4a,5,6,11-hexahydro-2H-naphtho[1,2-f]indazol-4-yl]-N-benzylmethanamine Traditional Name: [(3R,4R,11aS)-8-(4-fluorophenyl)-11a-methyl-3-(trifluoromethyl)-3,4,4a,5,6,11-hexahydro-2H-naphth[1,2-f]indazol-4-yl]methyl-benzyl-amine Formula: C31H31F4N3 MolecularWeight: 521.591553

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3=C(C=C1CCC4C2=CCC(C4CNCC5=CC=CC=C5)C(F)(F)F)N(N=C3)C6=CC=C(C=C6)F

Isomeric SMILES

C[C@]12CC3=C(C=C1CCC4C2=CC[C@H]([C@@H]4CNCC5=CC=CC=C5)C(F)(F)F)N(N=C3)C6=CC=C(C=C6)F

InChI

InChI=1S/C31H31F4N3/c1-30-16-21-18-37-38(24-10-8-23(32)9-11-24)29(21)15-22(30)7-12-25-26(19-36-17-20-5-3-2-4-6-20)28(31(33,34)35)14-13-27(25)30/h2-6,8-11,13,15,18,25-26,28,36H,7,12,14,16-17,19H2,1H3/t25?,26-,28-,30+/m1/s1