(2R,3S)-3-(4-aminocarbonylphenyl)-2-oxidanyl-3-[[(1S)-1-phenylethyl]amino]propanoate

Systemtic Name: (2R,3S)-3-(4-aminocarbonylphenyl)-2-oxidanyl-3-[[(1S)-1-phenylethyl]amino]propanoate Openeye Name: (2R,3S)-3-(4-carbamoylphenyl)-2-hydroxy-3-[[(1S)-1-phenylethyl]amino]propanoate CAS Name: (2R,3S)-3-(4-carbamoylphenyl)-2-hydroxy-3-[[(1S)-1-phenylethyl]amino]propanoate IUPAC Name: (2R,3S)-3-(4-carbamoylphenyl)-2-hydroxy-3-[[(1S)-1-phenylethyl]amino]propanoate Traditional Name: (2R,3S)-3-(4-carbamoylphenyl)-2-hydroxy-3-[[(1S)-1-phenylethyl]amino]propionate Formula: C18H19N2O4- MolecularWeight: 327.35446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(C2=CC=C(C=C2)C(=O)N)C(C(=O)[O-])O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N[C@@H](C2=CC=C(C=C2)C(=O)N)[C@H](C(=O)[O-])O

InChI

InChI=1S/C18H20N2O4/c1-11(12-5-3-2-4-6-12)20-15(16(21)18(23)24)13-7-9-14(10-8-13)17(19)22/h2-11,15-16,20-21H,1H3,(H2,19,22)(H,23,24)/p-1/t11-,15-,16+/m0/s1