2-[carboxy-[2-(4-pyridin-3-ylphenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(4-pyridin-3-ylphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-[4-(3-pyridyl)phenyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-[4-(3-pyridinyl)phenyl]ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(4-pyridin-3-ylphenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-[4-(3-pyridyl)phenyl]ethyl]amino]-4-methyl-valeric acid Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O4/c1-14(2)12-18(19(23)24)22(20(25)26)11-9-15-5-7-16(8-6-15)17-4-3-10-21-13-17/h3-8,10,13-14,18H,9,11-12H2,1-2H3,(H,23,24)(H,25,26)