2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[1-[[(4-ethoxycarbonylcyclohexyl)amino]-oxomethyl]cyclopentyl]methyl]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-4-methylsulfonylbutanoic acid Traditional Name: 2-[[1-[(4-carbethoxycyclohexyl)carbamoyl]cyclopentyl]methyl]-4-mesyl-butyric acid Formula: C21H35NO7S MolecularWeight: 445.5701

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)NC(=O)C2(CCCC2)CC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CCOC(=O)C1CCC(CC1)NC(=O)C2(CCCC2)CC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C21H35NO7S/c1-3-29-19(25)15-6-8-17(9-7-15)22-20(26)21(11-4-5-12-21)14-16(18(23)24)10-13-30(2,27)28/h15-17H,3-14H2,1-2H3,(H,22,26)(H,23,24)