ethanedioate; 2-(7-methyl-1H-indol-1-ium-3-yl)ethylazanium

Systemtic Name: ethanedioate; 2-(7-methyl-1H-indol-1-ium-3-yl)ethylazanium Openeye Name: 2-(7-methyl-1H-indol-1-ium-3-yl)ethylammonium; oxalate CAS Name: 2-(7-methyl-1H-indol-1-ium-3-yl)ethylammonium; oxalate IUPAC Name: 2-(7-methyl-1H-indol-1-ium-3-yl)ethylazanium; oxalate Traditional Name: 2-(7-methyl-1H-indol-1-ium-3-yl)ethylammonium; oxalate Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1[NH2+]C=C2CC[NH3+].C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC1=CC=CC2=C1[NH2+]C=C2CC[NH3+].C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C11H14N2.C2H2O4/c1-8-3-2-4-10-9(5-6-12)7-13-11(8)10;3-1(4)2(5)6/h2-4,7,13H,5-6,12H2,1H3;(H,3,4)(H,5,6)