methane; 4-[(Z)-N'-oxidanylcarbamimidoyl]benzoic acid

Systemtic Name: methane; 4-[(Z)-N'-oxidanylcarbamimidoyl]benzoic acid Openeye Name: 4-[(Z)-N'-hydroxycarbamimidoyl]benzoic acid; methane CAS Name: 4-[(Z)-amino(hydroxyimino)methyl]benzoic acid; methane IUPAC Name: 4-[(Z)-N'-hydroxycarbamimidoyl]benzoic acid; methane Traditional Name: 4-[(Z)-aminocarbohydroximoyl]benzoic acid; methane Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

C.C1=CC(=CC=C1C(=NO)N)C(=O)O

Isomeric SMILES

C.C1=CC(=CC=C1/C(=N/O)/N)C(=O)O

InChI

InChI=1S/C8H8N2O3.CH4/c9-7(10-13)5-1-3-6(4-2-5)8(11)12;/h1-4,13H,(H2,9,10)(H,11,12);1H4