3-[2-(hydroxymethyl)cyclopropyl]-1-(4-methylphenyl)sulfonyl-indole-5-carbonitrile

Systemtic Name: 3-[2-(hydroxymethyl)cyclopropyl]-1-(4-methylphenyl)sulfonyl-indole-5-carbonitrile Openeye Name: 3-[2-(hydroxymethyl)cyclopropyl]-1-(p-tolylsulfonyl)indole-5-carbonitrile CAS Name: 3-[2-(hydroxymethyl)cyclopropyl]-1-(4-methylphenyl)sulfonyl-5-indolecarbonitrile IUPAC Name: 3-[2-(hydroxymethyl)cyclopropyl]-1-(4-methylphenyl)sulfonylindole-5-carbonitrile Traditional Name: 3-(2-methylolcyclopropyl)-1-tosyl-indole-5-carbonitrile Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C#N)C4CC4CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C#N)C4CC4CO

InChI

InChI=1S/C20H18N2O3S/c1-13-2-5-16(6-3-13)26(24,25)22-11-19(17-9-15(17)12-23)18-8-14(10-21)4-7-20(18)22/h2-8,11,15,17,23H,9,12H2,1H3