9-azanyl-2-ethyl-3-methyl-6-phenyl-nonanoic acid

Systemtic Name: 9-azanyl-2-ethyl-3-methyl-6-phenyl-nonanoic acid Openeye Name: 9-amino-2-ethyl-3-methyl-6-phenyl-nonanoic acid CAS Name: 9-amino-2-ethyl-3-methyl-6-phenylnonanoic acid IUPAC Name: 9-amino-2-ethyl-3-methyl-6-phenylnonanoic acid Traditional Name: 9-amino-2-ethyl-3-methyl-6-phenyl-pelargonic acid Formula: C18H29NO2 MolecularWeight: 291.42836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)CCC(CCCN)C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCC(C(C)CCC(CCCN)C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C18H29NO2/c1-3-17(18(20)21)14(2)11-12-16(10-7-13-19)15-8-5-4-6-9-15/h4-6,8-9,14,16-17H,3,7,10-13,19H2,1-2H3,(H,20,21)