propanedioate; trimethyl-(phenylmethyl)azanium

Systemtic Name: propanedioate; trimethyl-(phenylmethyl)azanium Openeye Name: benzyl(trimethyl)ammonium; propanedioate CAS Name: propanedioate; trimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl(trimethyl)azanium; propanedioate Traditional Name: benzyl(trimethyl)ammonium; malonate Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=CC=CC=C1.C[N+](C)(C)CC1=CC=CC=C1.C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CC1=CC=CC=C1.C[N+](C)(C)CC1=CC=CC=C1.C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/2C10H16N.C3H4O4/c2*1-11(2,3)9-10-7-5-4-6-8-10;4-2(5)1-3(6)7/h2*4-8H,9H2,1-3H3;1H2,(H,4,5)(H,6,7)/q2*+1;/p-2