2-acetamido-5-(4-hydroxyphenyl)pent-4-ynoic acid

Systemtic Name: 2-acetamido-5-(4-hydroxyphenyl)pent-4-ynoic acid Openeye Name: 2-acetamido-5-(4-hydroxyphenyl)pent-4-ynoic acid CAS Name: 2-acetamido-5-(4-hydroxyphenyl)-4-pentynoic acid IUPAC Name: 2-acetamido-5-(4-hydroxyphenyl)pent-4-ynoic acid Traditional Name: 2-acetamido-5-(4-hydroxyphenyl)pent-4-ynoic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO4/c1-9(15)14-12(13(17)18)4-2-3-10-5-7-11(16)8-6-10/h5-8,12,16H,4H2,1H3,(H,14,15)(H,17,18)