(4R)-4-(2-oxidanylideneoctanoylamino)-5-phenyl-pentanoic acid

Systemtic Name: (4R)-4-(2-oxidanylideneoctanoylamino)-5-phenyl-pentanoic acid Openeye Name: (4R)-4-(2-oxooctanoylamino)-5-phenyl-pentanoic acid CAS Name: (4R)-4-(1,2-dioxooctylamino)-5-phenylpentanoic acid IUPAC Name: (4R)-4-(2-oxooctanoylamino)-5-phenylpentanoic acid Traditional Name: (4R)-4-(2-ketooctanoylamino)-5-phenyl-valeric acid Formula: C19H27NO4 MolecularWeight: 333.42198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C(=O)NC(CCC(=O)O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(=O)C(=O)N[C@H](CCC(=O)O)CC1=CC=CC=C1

InChI

InChI=1S/C19H27NO4/c1-2-3-4-8-11-17(21)19(24)20-16(12-13-18(22)23)14-15-9-6-5-7-10-15/h5-7,9-10,16H,2-4,8,11-14H2,1H3,(H,20,24)(H,22,23)/t16-/m1/s1