1-ethynyl-2-(4-methylphenyl)sulfonyl-9-prop-2-enyl-3,4-dihydro-1H-pyrido[3,4-b]indole

Systemtic Name: 1-ethynyl-2-(4-methylphenyl)sulfonyl-9-prop-2-enyl-3,4-dihydro-1H-pyrido[3,4-b]indole Openeye Name: 9-allyl-1-ethynyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indole CAS Name: 1-ethynyl-2-(4-methylphenyl)sulfonyl-9-prop-2-enyl-3,4-dihydro-1H-pyrido[3,4-b]indole IUPAC Name: 1-ethynyl-2-(4-methylphenyl)sulfonyl-9-prop-2-enyl-3,4-dihydro-1H-pyrido[3,4-b]indole Traditional Name: 9-allyl-1-ethynyl-2-tosyl-3,4-dihydro-1H-$b-carboline Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2C#C)N(C4=CC=CC=C34)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2C#C)N(C4=CC=CC=C34)CC=C

InChI

InChI=1S/C23H22N2O2S/c1-4-15-24-22-9-7-6-8-19(22)20-14-16-25(21(5-2)23(20)24)28(26,27)18-12-10-17(3)11-13-18/h2,4,6-13,21H,1,14-16H2,3H3