4-[2-[(4-methylphenyl)sulfonyloxymethyl]butyl]-3-(phenylmethyl)-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate

Systemtic Name: 4-[2-[(4-methylphenyl)sulfonyloxymethyl]butyl]-3-(phenylmethyl)-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate Openeye Name: 3-benzyl-4-[2-(p-tolylsulfonyloxymethyl)butyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate CAS Name: 4-[2-[(4-methylphenyl)sulfonyloxymethyl]butyl]-3-(phenylmethyl)-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate IUPAC Name: 3-benzyl-4-[2-[(4-methylphenyl)sulfonyloxymethyl]butyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate Traditional Name: 3-benzyl-4-[2-(tosyloxymethyl)butyl]-1,2,3a,4,5,7-hexahydropyrrolo[2,3-d]carbazole-6-carboxylate Formula: C34H37N2O5S- MolecularWeight: 585.73298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1CC(=C2C3(C1N(CC3)CC4=CC=CC=C4)C5=CC=CC=C5N2)C(=O)[O-])COS(=O)(=O)C6=CC=C(C=C6)C

Isomeric SMILES

CCC(CC1CC(=C2C3(C1N(CC3)CC4=CC=CC=C4)C5=CC=CC=C5N2)C(=O)[O-])COS(=O)(=O)C6=CC=C(C=C6)C

InChI

InChI=1S/C34H38N2O5S/c1-3-24(22-41-42(39,40)27-15-13-23(2)14-16-27)19-26-20-28(33(37)38)31-34(29-11-7-8-12-30(29)35-31)17-18-36(32(26)34)21-25-9-5-4-6-10-25/h4-16,24,26,32,35H,3,17-22H2,1-2H3,(H,37,38)/p-1