2-[3-[(2-azanyl-3-phenyl-propanoyl)amino]propanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[3-[(2-azanyl-3-phenyl-propanoyl)amino]propanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[3-[(2-amino-3-phenyl-propanoyl)amino]propanoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[3-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[3-[(2-amino-3-phenylpropanoyl)amino]propanoylamino]-4-methylpentanoic acid Traditional Name: 4-methyl-2-[3-(phenylalanylamino)propanoylamino]valeric acid Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O4/c1-12(2)10-15(18(24)25)21-16(22)8-9-20-17(23)14(19)11-13-6-4-3-5-7-13/h3-7,12,14-15H,8-11,19H2,1-2H3,(H,20,23)(H,21,22)(H,24,25)