N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-3,4,5-tris(oxidanyl)benzamide

Systemtic Name: N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-3,4,5-tris(oxidanyl)benzamide Openeye Name: 3,4,5-trihydroxy-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]benzamide CAS Name: 3,4,5-trihydroxy-N-[(1-methyl-4-piperidin-1-iumylidene)amino]benzamide IUPAC Name: 3,4,5-trihydroxy-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]benzamide Traditional Name: 3,4,5-trihydroxy-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]benzamide Formula: C13H18N3O4+ MolecularWeight: 280.29972

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NNC(=O)C2=CC(=C(C(=C2)O)O)O)CC1

Isomeric SMILES

C[NH+]1CCC(=NNC(=O)C2=CC(=C(C(=C2)O)O)O)CC1

InChI

InChI=1S/C13H17N3O4/c1-16-4-2-9(3-5-16)14-15-13(20)8-6-10(17)12(19)11(18)7-8/h6-7,17-19H,2-5H2,1H3,(H,15,20)/p+1