(2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(3-hydroxyphenyl)propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(3-hydroxyphenyl)propanoic acid Openeye Name: (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(3-hydroxyphenyl)propanoic acid CAS Name: (2S)-2-[[(2S)-2-acetamido-1-oxopropyl]amino]-3-(3-hydroxyphenyl)propanoic acid IUPAC Name: (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(3-hydroxyphenyl)propanoic acid Traditional Name: (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(3-hydroxyphenyl)propionic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC1=CC(=CC=C1)O)C(=O)O)NC(=O)C

InChI

InChI=1S/C14H18N2O5/c1-8(15-9(2)17)13(19)16-12(14(20)21)7-10-4-3-5-11(18)6-10/h3-6,8,12,18H,7H2,1-2H3,(H,15,17)(H,16,19)(H,20,21)/t8-,12-/m0/s1