[1-[2-[(3-chloranyl-1H-indol-6-yl)carbonyl-phenyl-amino]ethanoyl]piperidin-4-yl]methyl methanesulfonate

Systemtic Name: [1-[2-[(3-chloranyl-1H-indol-6-yl)carbonyl-phenyl-amino]ethanoyl]piperidin-4-yl]methyl methanesulfonate Openeye Name: [1-[2-(N-(3-chloro-1H-indole-6-carbonyl)anilino)acetyl]-4-piperidyl]methyl methanesulfonate CAS Name: methanesulfonic acid [1-[2-(N-[(3-chloro-1H-indol-6-yl)-oxomethyl]anilino)-1-oxoethyl]-4-piperidinyl]methyl ester IUPAC Name: [1-[2-(N-(3-chloro-1H-indole-6-carbonyl)anilino)acetyl]piperidin-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [1-[2-(N-(3-chloro-1H-indole-6-carbonyl)anilino)acetyl]-4-piperidyl]methyl ester Formula: C24H26ClN3O5S MolecularWeight: 503.99834

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1CCN(CC1)C(=O)CN(C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=CN4)Cl

Isomeric SMILES

CS(=O)(=O)OCC1CCN(CC1)C(=O)CN(C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=CN4)Cl

InChI

InChI=1S/C24H26ClN3O5S/c1-34(31,32)33-16-17-9-11-27(12-10-17)23(29)15-28(19-5-3-2-4-6-19)24(30)18-7-8-20-21(25)14-26-22(20)13-18/h2-8,13-14,17,26H,9-12,15-16H2,1H3