methyl 4-(4-methylphenyl)sulfonyloxy-9H-pyrido[3,4-b]indole-1-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)sulfonyloxy-9H-pyrido[3,4-b]indole-1-carboxylate Openeye Name: methyl 4-(p-tolylsulfonyloxy)-9H-pyrido[3,4-b]indole-1-carboxylate CAS Name: 4-(4-methylphenyl)sulfonyloxy-9H-pyrido[3,4-b]indole-1-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)sulfonyloxy-9H-pyrido[3,4-b]indole-1-carboxylate Traditional Name: 4-tosyloxy-9H-$b-carboline-1-carboxylic acid methyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CN=C(C3=C2C4=CC=CC=C4N3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CN=C(C3=C2C4=CC=CC=C4N3)C(=O)OC

InChI

InChI=1S/C20H16N2O5S/c1-12-7-9-13(10-8-12)28(24,25)27-16-11-21-19(20(23)26-2)18-17(16)14-5-3-4-6-15(14)22-18/h3-11,22H,1-2H3