2-[carboxy-[3-(3-phenylpropanoylamino)propyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[3-(3-phenylpropanoylamino)propyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[3-(3-phenylpropanoylamino)propyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[3-[(1-oxo-3-phenylpropyl)amino]propyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[3-(3-phenylpropanoylamino)propyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[3-(hydrocinnamoylamino)propyl]amino]-4-methyl-valeric acid Formula: C19H28N2O5 MolecularWeight: 364.43602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCCNC(=O)CCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCCNC(=O)CCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C19H28N2O5/c1-14(2)13-16(18(23)24)21(19(25)26)12-6-11-20-17(22)10-9-15-7-4-3-5-8-15/h3-5,7-8,14,16H,6,9-13H2,1-2H3,(H,20,22)(H,23,24)(H,25,26)