[(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [(1R)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate CAS Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoic acid [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)propionic acid [(1R)-2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)OC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1CCCCCC1)OC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4/c1-15(21(26)22-17-11-7-2-3-8-12-17)27-19(25)14-13-18-23-20(24-28-18)16-9-5-4-6-10-16/h4-6,9-10,15,17H,2-3,7-8,11-14H2,1H3,(H,22,26)/t15-/m1/s1