methyl 4-[[4-[2-methoxyethyl-(3-methylsulfonylphenyl)sulfonyl-amino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[2-methoxyethyl-(3-methylsulfonylphenyl)sulfonyl-amino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[2-methoxyethyl-(3-methylsulfonylphenyl)sulfonyl-amino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[2-methoxyethyl-(3-methylsulfonylphenyl)sulfonylamino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[2-methoxyethyl-(3-methylsulfonylphenyl)sulfonylamino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[(3-mesylphenyl)sulfonyl-(2-methoxyethyl)amino]piperidino]methyl]benzoic acid methyl ester Formula: C24H32N2O7S2 MolecularWeight: 524.65008

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(C1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C

Isomeric SMILES

COCCN(C1CCN(CC1)CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C

InChI

InChI=1S/C24H32N2O7S2/c1-32-16-15-26(35(30,31)23-6-4-5-22(17-23)34(3,28)29)21-11-13-25(14-12-21)18-19-7-9-20(10-8-19)24(27)33-2/h4-10,17,21H,11-16,18H2,1-3H3