methyl 2-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-[2-methyl-5-(1-piperidylsulfonyl)benzoyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methyl-5-piperidin-1-ylsulfonylbenzoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-(2-methyl-5-piperidinosulfonyl-benzoyl)-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)C(=O)OC

InChI

InChI=1S/C26H29N3O5S/c1-17-6-8-19(35(32,33)29-11-4-3-5-12-29)15-20(17)25(30)28-13-10-24-22(16-28)21-14-18(26(31)34-2)7-9-23(21)27-24/h6-9,14-15,27H,3-5,10-13,16H2,1-2H3