2-methylidenebutanedioate; tetrabutylazanium

Systemtic Name: 2-methylidenebutanedioate; tetrabutylazanium Openeye Name: 2-methylenebutanedioate; tetrabutylammonium CAS Name: 2-methylenebutanedioate; tetrabutylammonium IUPAC Name: 2-methylidenebutanedioate; tetrabutylazanium Traditional Name: itaconate; tetrabutylammonium Formula: C37H76N2O4 MolecularWeight: 613.01034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C=C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C=C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/2C16H36N.C5H6O4/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-3(5(8)9)2-4(6)7/h2*5-16H2,1-4H3;1-2H2,(H,6,7)(H,8,9)/q2*+1;/p-2