2-methylidenebutanedioate; piperazin-1-ium

Systemtic Name: 2-methylidenebutanedioate; piperazin-1-ium Openeye Name: 2-methylenebutanedioate; piperazin-1-ium CAS Name: 2-methylenebutanedioate; piperazin-1-ium IUPAC Name: 2-methylidenebutanedioate; piperazin-1-ium Traditional Name: itaconate; piperazin-1-ium Formula: C13H26N4O4 MolecularWeight: 302.36994

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CC(=O)[O-])C(=O)[O-].C1CNCC[NH2+]1.C1CNCC[NH2+]1

Isomeric SMILES

C=C(CC(=O)[O-])C(=O)[O-].C1CNCC[NH2+]1.C1CNCC[NH2+]1

InChI

InChI=1S/C5H6O4.2C4H10N2/c1-3(5(8)9)2-4(6)7;2*1-2-6-4-3-5-1/h1-2H2,(H,6,7)(H,8,9);2*5-6H,1-4H2