(2R)-6-azanyl-2-[2-[carboxymethyl-(4-methoxycyclohexyl)carbonyl-amino]ethanoylamino]hexanoic acid

Systemtic Name: (2R)-6-azanyl-2-[2-[carboxymethyl-(4-methoxycyclohexyl)carbonyl-amino]ethanoylamino]hexanoic acid Openeye Name: (2R)-6-amino-2-[[2-[carboxymethyl-(4-methoxycyclohexanecarbonyl)amino]acetyl]amino]hexanoic acid CAS Name: (2R)-6-amino-2-[[2-[carboxymethyl-[(4-methoxycyclohexyl)-oxomethyl]amino]-1-oxoethyl]amino]hexanoic acid IUPAC Name: (2R)-6-amino-2-[[2-[carboxymethyl-(4-methoxycyclohexanecarbonyl)amino]acetyl]amino]hexanoic acid Traditional Name: (2R)-6-amino-2-[[2-[carboxymethyl-(4-methoxycyclohexanecarbonyl)amino]acetyl]amino]hexanoic acid Formula: C18H31N3O7 MolecularWeight: 401.45464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1)C(=O)N(CC(=O)NC(CCCCN)C(=O)O)CC(=O)O

Isomeric SMILES

COC1CCC(CC1)C(=O)N(CC(=O)N[C@H](CCCCN)C(=O)O)CC(=O)O

InChI

InChI=1S/C18H31N3O7/c1-28-13-7-5-12(6-8-13)17(25)21(11-16(23)24)10-15(22)20-14(18(26)27)4-2-3-9-19/h12-14H,2-11,19H2,1H3,(H,20,22)(H,23,24)(H,26,27)/t12?,13?,14-/m1/s1