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

Systemtic Name: 2-acetamido-5-(2-methanoylphenyl)pent-4-ynoic acid Openeye Name: 2-acetamido-5-(2-formylphenyl)pent-4-ynoic acid CAS Name: 2-acetamido-5-(2-formylphenyl)-4-pentynoic acid IUPAC Name: 2-acetamido-5-(2-formylphenyl)pent-4-ynoic acid Traditional Name: 2-acetamido-5-(2-formylphenyl)pent-4-ynoic acid Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC#CC1=CC=CC=C1C=O)C(=O)O

Isomeric SMILES

CC(=O)NC(CC#CC1=CC=CC=C1C=O)C(=O)O

InChI

InChI=1S/C14H13NO4/c1-10(17)15-13(14(18)19)8-4-7-11-5-2-3-6-12(11)9-16/h2-3,5-6,9,13H,8H2,1H3,(H,15,17)(H,18,19)