[8-cyano-3-(4-methylphenyl)sulfonyl-7,9-dihydro-6H-benzo[e]indol-8-yl] diethyl phosphate

Systemtic Name: [8-cyano-3-(4-methylphenyl)sulfonyl-7,9-dihydro-6H-benzo[e]indol-8-yl] diethyl phosphate Openeye Name: [8-cyano-3-(p-tolylsulfonyl)-7,9-dihydro-6H-benzo[e]indol-8-yl] diethyl phosphate CAS Name: phosphoric acid [8-cyano-3-(4-methylphenyl)sulfonyl-7,9-dihydro-6H-benzo[e]indol-8-yl] diethyl ester IUPAC Name: [8-cyano-3-(4-methylphenyl)sulfonyl-7,9-dihydro-6H-benzo[e]indol-8-yl] diethyl phosphate Traditional Name: phosphoric acid (8-cyano-3-tosyl-7,9-dihydro-6H-benz[e]indol-8-yl) diethyl ester Formula: C24H27N2O6PS MolecularWeight: 502.519741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1(CCC2=C(C1)C3=C(C=C2)N(C=C3)S(=O)(=O)C4=CC=C(C=C4)C)C#N

Isomeric SMILES

CCOP(=O)(OCC)OC1(CCC2=C(C1)C3=C(C=C2)N(C=C3)S(=O)(=O)C4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C24H27N2O6PS/c1-4-30-33(27,31-5-2)32-24(17-25)14-12-19-8-11-23-21(22(19)16-24)13-15-26(23)34(28,29)20-9-6-18(3)7-10-20/h6-11,13,15H,4-5,12,14,16H2,1-3H3