3-(4-nitrophenyl)prop-2-ynoic acid

Systemtic Name: 3-(4-nitrophenyl)prop-2-ynoic acid Openeye Name: 3-(4-nitrophenyl)prop-2-ynoic acid CAS Name: 3-(4-nitrophenyl)-2-propynoic acid IUPAC Name: 3-(4-nitrophenyl)prop-2-ynoic acid Traditional Name: 3-(4-nitrophenyl)propiolic acid Formula: C9H5NO4 MolecularWeight: 191.1403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H5NO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5H,(H,11,12)