8-oxidanylidene-8-(3-phenylpropylamino)octanoic acid

Systemtic Name: 8-oxidanylidene-8-(3-phenylpropylamino)octanoic acid Openeye Name: 8-oxo-8-(3-phenylpropylamino)octanoic acid CAS Name: 8-oxo-8-(3-phenylpropylamino)octanoic acid IUPAC Name: 8-oxo-8-(3-phenylpropylamino)octanoic acid Traditional Name: 8-keto-8-(3-phenylpropylamino)caprylic acid Formula: C17H25NO3 MolecularWeight: 291.3853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)CCCCCCC(=O)O

InChI

InChI=1S/C17H25NO3/c19-16(12-6-1-2-7-13-17(20)21)18-14-8-11-15-9-4-3-5-10-15/h3-5,9-10H,1-2,6-8,11-14H2,(H,18,19)(H,20,21)