dimethyl (Z)-2-(1-methylindazol-1-ium-2-yl)but-2-enedioate

Systemtic Name: dimethyl (Z)-2-(1-methylindazol-1-ium-2-yl)but-2-enedioate Openeye Name: dimethyl (Z)-2-(1-methylindazol-1-ium-2-yl)but-2-enedioate CAS Name: (Z)-2-(1-methyl-2-indazol-1-iumyl)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-(1-methylindazol-1-ium-2-yl)but-2-enedioate Traditional Name: (Z)-2-(1-methylindazol-1-ium-2-yl)but-2-enedioic acid dimethyl ester Formula: C14H15N2O4+ MolecularWeight: 275.2799

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC=CC2=CN1C(=CC(=O)OC)C(=O)OC

Isomeric SMILES

C[N+]1=C2C=CC=CC2=CN1/C(=C\C(=O)OC)/C(=O)OC

InChI

InChI=1S/C14H15N2O4/c1-15-11-7-5-4-6-10(11)9-16(15)12(14(18)20-3)8-13(17)19-2/h4-9H,1-3H3/q+1/b12-8-