benzene-1,2,4-tricarboxylic acid; (E)-octadec-9-enamide

Systemtic Name: benzene-1,2,4-tricarboxylic acid; (E)-octadec-9-enamide Openeye Name: benzene-1,2,4-tricarboxylic acid; (E)-octadec-9-enamide CAS Name: benzene-1,2,4-tricarboxylic acid; (E)-9-octadecenamide IUPAC Name: benzene-1,2,4-tricarboxylic acid; (E)-octadec-9-enamide Traditional Name: (E)-octadec-9-enamide; trimellitic acid Formula: C27H41NO7 MolecularWeight: 491.61694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)N.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)N.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C18H35NO.C9H6O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;10-7(11)4-1-2-5(8(12)13)6(3-4)9(14)15/h9-10H,2-8,11-17H2,1H3,(H2,19,20);1-3H,(H,10,11)(H,12,13)(H,14,15)/b10-9+;