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

Systemtic Name: 2-[carboxy-[2-(4-phenylmethoxyphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[2-(4-benzyloxyphenyl)ethyl-carboxy-amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-(4-phenylmethoxyphenyl)ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(4-phenylmethoxyphenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[2-(4-benzoxyphenyl)ethyl-carboxy-amino]-4-methyl-valeric acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H27NO5/c1-16(2)14-20(21(24)25)23(22(26)27)13-12-17-8-10-19(11-9-17)28-15-18-6-4-3-5-7-18/h3-11,16,20H,12-15H2,1-2H3,(H,24,25)(H,26,27)