2-acetyloxybenzoate; 1-methylpyridin-1-ium-3-carboxamide

Systemtic Name: 2-acetyloxybenzoate; 1-methylpyridin-1-ium-3-carboxamide Openeye Name: 2-acetoxybenzoate; 1-methylpyridin-1-ium-3-carboxamide CAS Name: 2-acetyloxybenzoate; 1-methyl-3-pyridin-1-iumcarboxamide IUPAC Name: 2-acetyloxybenzoate; 1-methylpyridin-1-ium-3-carboxamide Traditional Name: 2-acetoxybenzoate; 1-methylpyridin-1-ium-3-carboxamide Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)[O-].C[N+]1=CC=CC(=C1)C(=O)N

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)[O-].C[N+]1=CC=CC(=C1)C(=O)N

InChI

InChI=1S/C9H8O4.C7H8N2O/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;1-9-4-2-3-6(5-9)7(8)10/h2-5H,1H3,(H,11,12);2-5H,1H3,(H-,8,10)