ditetradecyl 2-azanylpentanedioate; 4-methylbenzenesulfonic acid

Systemtic Name: ditetradecyl 2-azanylpentanedioate; 4-methylbenzenesulfonic acid Openeye Name: ditetradecyl 2-aminopentanedioate; 4-methylbenzenesulfonic acid CAS Name: 2-aminopentanedioic acid ditetradecyl ester; 4-methylbenzenesulfonic acid IUPAC Name: ditetradecyl 2-aminopentanedioate; 4-methylbenzenesulfonic acid Traditional Name: 2-aminoglutaric acid dimyristyl ester; tosylic acid Formula: C40H73NO7S MolecularWeight: 712.07512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)CCC(C(=O)OCCCCCCCCCCCCCC)N.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)CCC(C(=O)OCCCCCCCCCCCCCC)N.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C33H65NO4.C7H8O3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-29-37-32(35)28-27-31(34)33(36)38-30-26-24-22-20-18-16-14-12-10-8-6-4-2;1-6-2-4-7(5-3-6)11(8,9)10/h31H,3-30,34H2,1-2H3;2-5H,1H3,(H,8,9,10)