2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 2-[(2-amino-4-methyl-pentanoyl)amino]-3-(4-benzyloxyphenyl)propanoic acid CAS Name: 2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-[(2-amino-4-methylpentanoyl)amino]-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 2-[(2-amino-4-methyl-pentanoyl)amino]-3-(4-benzoxyphenyl)propionic acid Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O)N

InChI

InChI=1S/C22H28N2O4/c1-15(2)12-19(23)21(25)24-20(22(26)27)13-16-8-10-18(11-9-16)28-14-17-6-4-3-5-7-17/h3-11,15,19-20H,12-14,23H2,1-2H3,(H,24,25)(H,26,27)