(2S)-2-[2-[[(2S)-2-azanylpropanoyl]amino]ethanoyl-phenyl-amino]propanoic acid

Systemtic Name: (2S)-2-[2-[[(2S)-2-azanylpropanoyl]amino]ethanoyl-phenyl-amino]propanoic acid Openeye Name: (2S)-2-(N-[2-[[(2S)-2-aminopropanoyl]amino]acetyl]anilino)propanoic acid CAS Name: (2S)-2-(N-[2-[[(2S)-2-amino-1-oxopropyl]amino]-1-oxoethyl]anilino)propanoic acid IUPAC Name: (2S)-2-(N-[2-[[(2S)-2-aminopropanoyl]amino]acetyl]anilino)propanoic acid Traditional Name: (2S)-2-(N-[2-[[(2S)-2-aminopropanoyl]amino]acetyl]anilino)propionic acid Formula: C14H19N3O4 MolecularWeight: 293.31836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)N(C1=CC=CC=C1)C(C)C(=O)O)N

Isomeric SMILES

C[C@@H](C(=O)NCC(=O)N(C1=CC=CC=C1)[C@@H](C)C(=O)O)N

InChI

InChI=1S/C14H19N3O4/c1-9(15)13(19)16-8-12(18)17(10(2)14(20)21)11-6-4-3-5-7-11/h3-7,9-10H,8,15H2,1-2H3,(H,16,19)(H,20,21)/t9-,10-/m0/s1