3-[2-(2-azanyl-4-methyl-pentanoyl)-3-methyl-phenyl]-2-formamido-propanoic acid

Systemtic Name: 3-[2-(2-azanyl-4-methyl-pentanoyl)-3-methyl-phenyl]-2-formamido-propanoic acid Openeye Name: 3-[2-(2-amino-4-methyl-pentanoyl)-3-methyl-phenyl]-2-formamido-propanoic acid CAS Name: 3-[2-(2-amino-4-methyl-1-oxopentyl)-3-methylphenyl]-2-formamidopropanoic acid IUPAC Name: 3-[2-(2-amino-4-methylpentanoyl)-3-methylphenyl]-2-formamidopropanoic acid Traditional Name: 3-[2-(2-amino-4-methyl-pentanoyl)-3-methyl-phenyl]-2-formamido-propionic acid Formula: C17H24N2O4 MolecularWeight: 320.38346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O4/c1-10(2)7-13(18)16(21)15-11(3)5-4-6-12(15)8-14(17(22)23)19-9-20/h4-6,9-10,13-14H,7-8,18H2,1-3H3,(H,19,20)(H,22,23)