(2R)-2-[2-(4-hydroxyphenyl)ethanoylamino]-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: (2R)-2-[2-(4-hydroxyphenyl)ethanoylamino]-3-(1H-imidazol-5-yl)propanoate Openeye Name: (2R)-2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-(1H-imidazol-5-yl)propanoate CAS Name: (2R)-2-[[2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: (2R)-2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: (2R)-2-[[2-(4-hydroxyphenyl)acetyl]amino]-3-(1H-imidazol-5-yl)propionate Formula: C14H14N3O4- MolecularWeight: 288.27866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC(CC2=CN=CN2)C(=O)[O-])O

Isomeric SMILES

C1=CC(=CC=C1CC(=O)N[C@H](CC2=CN=CN2)C(=O)[O-])O

InChI

InChI=1S/C14H15N3O4/c18-11-3-1-9(2-4-11)5-13(19)17-12(14(20)21)6-10-7-15-8-16-10/h1-4,7-8,12,18H,5-6H2,(H,15,16)(H,17,19)(H,20,21)/p-1/t12-/m1/s1