2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-3-(ethylamino)propanoic acid

Systemtic Name: 2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-3-(ethylamino)propanoic acid Openeye Name: 2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-3-(ethylamino)propanoic acid CAS Name: 2-[[1-[[(4-ethoxycarbonylcyclohexyl)amino]-oxomethyl]cyclopentyl]methyl]-3-(ethylamino)propanoic acid IUPAC Name: 2-[[1-[(4-ethoxycarbonylcyclohexyl)carbamoyl]cyclopentyl]methyl]-3-(ethylamino)propanoic acid Traditional Name: 2-[[1-[(4-carbethoxycyclohexyl)carbamoyl]cyclopentyl]methyl]-3-(ethylamino)propionic acid Formula: C21H36N2O5 MolecularWeight: 396.52094

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC(CC1(CCCC1)C(=O)NC2CCC(CC2)C(=O)OCC)C(=O)O

Isomeric SMILES

CCNCC(CC1(CCCC1)C(=O)NC2CCC(CC2)C(=O)OCC)C(=O)O

InChI

InChI=1S/C21H36N2O5/c1-3-22-14-16(18(24)25)13-21(11-5-6-12-21)20(27)23-17-9-7-15(8-10-17)19(26)28-4-2/h15-17,22H,3-14H2,1-2H3,(H,23,27)(H,24,25)