hexanedioic acid; tridecan-2-amine

Systemtic Name: hexanedioic acid; tridecan-2-amine Openeye Name: adipic acid; tridecan-2-amine CAS Name: hexanedioic acid; 2-tridecanamine IUPAC Name: hexanedioic acid; tridecan-2-amine Traditional Name: adipic acid; 1-methyldodecylamine Formula: C19H39NO4 MolecularWeight: 345.51726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)N.C(CCC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCC(C)N.C(CCC(=O)O)CC(=O)O

InChI

InChI=1S/C13H29N.C6H10O4/c1-3-4-5-6-7-8-9-10-11-12-13(2)14;7-5(8)3-1-2-4-6(9)10/h13H,3-12,14H2,1-2H3;1-4H2,(H,7,8)(H,9,10)