2-[carboxy-[2-(4-phenethyloxyphenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(4-phenethyloxyphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-(4-phenethyloxyphenyl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(4-phenethyloxyphenyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(4-phenethyloxyphenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-(4-phenethyloxyphenyl)ethyl]amino]-4-methyl-valeric acid Formula: C23H29NO5 MolecularWeight: 399.48006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)OCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)OCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C23H29NO5/c1-17(2)16-21(22(25)26)24(23(27)28)14-12-19-8-10-20(11-9-19)29-15-13-18-6-4-3-5-7-18/h3-11,17,21H,12-16H2,1-2H3,(H,25,26)(H,27,28)