4-[(4'aS,5S)-1'-(4-fluorophenyl)-4'a-methyl-2-oxidanylidene-spiro[1,3-oxazolidine-5,5'-4,6,7,8-tetrahydrobenzo[f]indazole]-3-yl]benzoic acid

Systemtic Name: 4-[(4'aS,5S)-1'-(4-fluorophenyl)-4'a-methyl-2-oxidanylidene-spiro[1,3-oxazolidine-5,5'-4,6,7,8-tetrahydrobenzo[f]indazole]-3-yl]benzoic acid Openeye Name: 4-[(4aS,5S)-1-(4-fluorophenyl)-4a-methyl-2'-oxo-spiro[4,6,7,8-tetrahydrobenzo[f]indazole-5,5'-oxazolidine]-3'-yl]benzoic acid CAS Name: 4-[(4aS,5S)-1-(4-fluorophenyl)-4a-methyl-2'-oxo-3'-spiro[4,6,7,8-tetrahydrobenzo[f]indazole-5,5'-oxazolidine]yl]benzoic acid IUPAC Name: 4-[(4'aS,5S)-1'-(4-fluorophenyl)-4'a-methyl-2-oxospiro[1,3-oxazolidine-5,5'-4,6,7,8-tetrahydrobenzo[f]indazole]-3-yl]benzoic acid Traditional Name: 4-[(4aS,5S)-1-(4-fluorophenyl)-2'-keto-4a-methyl-spiro[4,6,7,8-tetrahydrobenz[f]indazole-5,5'-oxazolidine]-3'-yl]benzoic acid Formula: C27H24FN3O4 MolecularWeight: 473.495563

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3=C(C=C1CCCC24CN(C(=O)O4)C5=CC=C(C=C5)C(=O)O)N(N=C3)C6=CC=C(C=C6)F

Isomeric SMILES

C[C@]12CC3=C(C=C1CCC[C@@]24CN(C(=O)O4)C5=CC=C(C=C5)C(=O)O)N(N=C3)C6=CC=C(C=C6)F

InChI

InChI=1S/C27H24FN3O4/c1-26-14-18-15-29-31(22-10-6-20(28)7-11-22)23(18)13-19(26)3-2-12-27(26)16-30(25(34)35-27)21-8-4-17(5-9-21)24(32)33/h4-11,13,15H,2-3,12,14,16H2,1H3,(H,32,33)/t26-,27+/m0/s1