[4-methoxycarbonyl-3,5-bis(oxidanyl)phenyl]methylazanium

Systemtic Name: [4-methoxycarbonyl-3,5-bis(oxidanyl)phenyl]methylazanium Openeye Name: (3,5-dihydroxy-4-methoxycarbonyl-phenyl)methylammonium CAS Name: (3,5-dihydroxy-4-methoxycarbonylphenyl)methylammonium IUPAC Name: (3,5-dihydroxy-4-methoxycarbonylphenyl)methylazanium Traditional Name: (4-carbomethoxy-3,5-dihydroxy-benzyl)ammonium Formula: C9H12NO4+ MolecularWeight: 198.19588

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1O)C[NH3+])O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1O)C[NH3+])O

InChI

InChI=1S/C9H11NO4/c1-14-9(13)8-6(11)2-5(4-10)3-7(8)12/h2-3,11-12H,4,10H2,1H3/p+1