tert-butyl 1-(2-azanyl-2-oxidanylidene-ethyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-9-carboxylate

Systemtic Name: tert-butyl 1-(2-azanyl-2-oxidanylidene-ethyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-9-carboxylate Openeye Name: tert-butyl 1-(2-amino-2-oxo-ethyl)-2-(p-tolylsulfonyl)-3,4-dihydro-1H-pyrido[3,4-b]indole-9-carboxylate CAS Name: 1-(2-amino-2-oxoethyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-9-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(2-amino-2-oxoethyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-9-carboxylate Traditional Name: 1-(2-amino-2-keto-ethyl)-2-tosyl-3,4-dihydro-1H-$b-carboline-9-carboxylic acid tert-butyl ester Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2CC(=O)N)N(C4=CC=CC=C34)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2CC(=O)N)N(C4=CC=CC=C34)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H29N3O5S/c1-16-9-11-17(12-10-16)34(31,32)27-14-13-19-18-7-5-6-8-20(18)28(24(30)33-25(2,3)4)23(19)21(27)15-22(26)29/h5-12,21H,13-15H2,1-4H3,(H2,26,29)