(2R)-2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: (2R)-2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: (2R)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: (2R)-2-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2R)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: (2R)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(4-hydroxyphenyl)propionic acid Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)N[C@H](CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C16H16N2O5/c1-9(19)11-7-13(17-8-11)15(21)18-14(16(22)23)6-10-2-4-12(20)5-3-10/h2-5,7-8,14,17,20H,6H2,1H3,(H,18,21)(H,22,23)/t14-/m1/s1