5-chloranyl-2-(4-methylphenyl)sulfonyl-3,4,6,7-tetrahydro-1H-isoindole-5-carbonitrile

Systemtic Name: 5-chloranyl-2-(4-methylphenyl)sulfonyl-3,4,6,7-tetrahydro-1H-isoindole-5-carbonitrile Openeye Name: 5-chloro-2-(p-tolylsulfonyl)-3,4,6,7-tetrahydro-1H-isoindole-5-carbonitrile CAS Name: 5-chloro-2-(4-methylphenyl)sulfonyl-3,4,6,7-tetrahydro-1H-isoindole-5-carbonitrile IUPAC Name: 5-chloro-2-(4-methylphenyl)sulfonyl-3,4,6,7-tetrahydro-1H-isoindole-5-carbonitrile Traditional Name: 5-chloro-2-tosyl-3,4,6,7-tetrahydro-1H-isoindole-5-carbonitrile Formula: C16H17ClN2O2S MolecularWeight: 336.83638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C2)CC(CC3)(C#N)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C2)CC(CC3)(C#N)Cl

InChI

InChI=1S/C16H17ClN2O2S/c1-12-2-4-15(5-3-12)22(20,21)19-9-13-6-7-16(17,11-18)8-14(13)10-19/h2-5H,6-10H2,1H3