(3'R,3'aS,7'aS)-3'a-(3,4-dimethoxyphenyl)-1'-(4-methylphenyl)sulfonyl-spiro[1,3-dioxolane-2,6'-2,3,4,5,7,7a-hexahydroindole]-3'-carbaldehyde

Systemtic Name: (3'R,3'aS,7'aS)-3'a-(3,4-dimethoxyphenyl)-1'-(4-methylphenyl)sulfonyl-spiro[1,3-dioxolane-2,6'-2,3,4,5,7,7a-hexahydroindole]-3'-carbaldehyde Openeye Name: (3'R,3'aS,7'aS)-3'a-(3,4-dimethoxyphenyl)-1'-(p-tolylsulfonyl)spiro[1,3-dioxolane-2,6'-2,3,4,5,7,7a-hexahydroindole]-3'-carbaldehyde CAS Name: (3'R,3'aS,7'aS)-3'a-(3,4-dimethoxyphenyl)-1'-(4-methylphenyl)sulfonyl-3'-spiro[1,3-dioxolane-2,6'-2,3,4,5,7,7a-hexahydroindole]carboxaldehyde IUPAC Name: (3'R,3'aS,7'aS)-3'a-(3,4-dimethoxyphenyl)-1'-(4-methylphenyl)sulfonylspiro[1,3-dioxolane-2,6'-2,3,4,5,7,7a-hexahydroindole]-3'-carbaldehyde Traditional Name: (3'R,3'aS,7'aS)-3'a-(3,4-dimethoxyphenyl)-1'-tosyl-spiro[1,3-dioxolane-2,6'-2,3,4,5,7,7a-hexahydroindole]-3'-carbaldehyde Formula: C26H31NO7S MolecularWeight: 501.59184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C3(C2CC4(CC3)OCCO4)C5=CC(=C(C=C5)OC)OC)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]([C@]3([C@@H]2CC4(CC3)OCCO4)C5=CC(=C(C=C5)OC)OC)C=O

InChI

InChI=1S/C26H31NO7S/c1-18-4-7-21(8-5-18)35(29,30)27-16-20(17-28)26(19-6-9-22(31-2)23(14-19)32-3)11-10-25(15-24(26)27)33-12-13-34-25/h4-9,14,17,20,24H,10-13,15-16H2,1-3H3/t20-,24+,26-/m1/s1