ethyl 4-[4-(6-methylheptan-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(6-methylheptan-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(1,5-dimethylhexylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[(6-methylheptan-2-ylamino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(6-methylheptan-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(1,5-dimethylhexylcarbamoyl)piperidino]sulfonylbenzoic acid ethyl ester Formula: C23H36N2O5S MolecularWeight: 452.60734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCCC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCCC(C)C

InChI

InChI=1S/C23H36N2O5S/c1-5-30-23(27)20-9-11-21(12-10-20)31(28,29)25-15-13-19(14-16-25)22(26)24-18(4)8-6-7-17(2)3/h9-12,17-19H,5-8,13-16H2,1-4H3,(H,24,26)