methyl (2S)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoate CAS Name: (2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoate Traditional Name: (2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5/c1-20-13(19)11(7-16)15-12(18)10(14)6-8-2-4-9(17)5-3-8/h2-5,10-11,16-17H,6-7,14H2,1H3,(H,15,18)/t10-,11-/m0/s1