2-[2-[5-cyano-1-(4-methylphenyl)sulfonyl-indol-3-yl]cyclopropyl]prop-2-enoate

Systemtic Name: 2-[2-[5-cyano-1-(4-methylphenyl)sulfonyl-indol-3-yl]cyclopropyl]prop-2-enoate Openeye Name: 2-[2-[5-cyano-1-(p-tolylsulfonyl)indol-3-yl]cyclopropyl]prop-2-enoate CAS Name: 2-[2-[5-cyano-1-(4-methylphenyl)sulfonyl-3-indolyl]cyclopropyl]-2-propenoate IUPAC Name: 2-[2-[5-cyano-1-(4-methylphenyl)sulfonylindol-3-yl]cyclopropyl]prop-2-enoate Traditional Name: 2-[2-(5-cyano-1-tosyl-indol-3-yl)cyclopropyl]acrylate Formula: C22H17N2O4S- MolecularWeight: 405.44638

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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)C4CC4C(=C)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C#N)C4CC4C(=C)C(=O)[O-]

InChI

InChI=1S/C22H18N2O4S/c1-13-3-6-16(7-4-13)29(27,28)24-12-20(18-10-17(18)14(2)22(25)26)19-9-15(11-23)5-8-21(19)24/h3-9,12,17-18H,2,10H2,1H3,(H,25,26)/p-1