2-[[1-[(3-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]hex-4-ynoic acid

Systemtic Name: 2-[[1-[(3-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]hex-4-ynoic acid Openeye Name: 2-[[1-[(3-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]hex-4-ynoic acid CAS Name: 2-[[1-[[(3-ethoxycarbonylcyclohexyl)amino]-oxomethyl]cyclopentyl]methyl]-4-hexynoic acid IUPAC Name: 2-[[1-[(3-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]hex-4-ynoic acid Traditional Name: 2-[[1-[(3-carbethoxycyclohexyl)carbamoyl]cyclopentyl]methyl]hex-4-ynoic acid Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(C1)NC(=O)C2(CCCC2)CC(CC#CC)C(=O)O

Isomeric SMILES

CCOC(=O)C1CCCC(C1)NC(=O)C2(CCCC2)CC(CC#CC)C(=O)O

InChI

InChI=1S/C22H33NO5/c1-3-5-9-17(19(24)25)15-22(12-6-7-13-22)21(27)23-18-11-8-10-16(14-18)20(26)28-4-2/h16-18H,4,6-15H2,1-2H3,(H,23,27)(H,24,25)