N,N-dimethyldodecan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: N,N-dimethyldodecan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: N,N-dimethyldodecan-1-amine citrate CAS Name: N,N-dimethyl-1-dodecanamine; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: N,N-dimethyldodecan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: lauryl(dimethyl)amine citrate Formula: C20H36NO7-3 MolecularWeight: 402.50234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C)C.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCN(C)C.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C14H31N.C6H8O7/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-14H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3