methyl 2-[4-(cycloheptylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(cycloheptylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(cycloheptylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[(cycloheptylamino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(cycloheptylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(cycloheptylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCCCC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCCCC3

InChI

InChI=1S/C21H30N2O5S/c1-28-21(25)18-10-6-7-11-19(18)29(26,27)23-14-12-16(13-15-23)20(24)22-17-8-4-2-3-5-9-17/h6-7,10-11,16-17H,2-5,8-9,12-15H2,1H3,(H,22,24)