(2S)-2-[[1-(methoxycarbonylamino)cyclohexyl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[1-(methoxycarbonylamino)cyclohexyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[1-(methoxycarbonylamino)cyclohexanecarbonyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[[1-(methoxycarbonylamino)cyclohexyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[1-(methoxycarbonylamino)cyclohexanecarbonyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[1-(carbomethoxyamino)cyclohexanecarbonyl]amino]-3-phenyl-propionic acid Formula: C18H24N2O5 MolecularWeight: 348.39356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1(CCCCC1)C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC(=O)NC1(CCCCC1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H24N2O5/c1-25-17(24)20-18(10-6-3-7-11-18)16(23)19-14(15(21)22)12-13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3,(H,19,23)(H,20,24)(H,21,22)/t14-/m0/s1