hexadecanoate; 1-methylpyrrole-2,5-dione

Systemtic Name: hexadecanoate; 1-methylpyrrole-2,5-dione Openeye Name: hexadecanoate; 1-methylpyrrole-2,5-dione CAS Name: hexadecanoate; 1-methylpyrrole-2,5-dione IUPAC Name: hexadecanoate; 1-methylpyrrole-2,5-dione Traditional Name: 1-methyl-3-pyrroline-2,5-quinone; palmitate Formula: C21H36NO4- MolecularWeight: 366.51484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)[O-].CN1C(=O)C=CC1=O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)[O-].CN1C(=O)C=CC1=O

InChI

InChI=1S/C16H32O2.C5H5NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;1-6-4(7)2-3-5(6)8/h2-15H2,1H3,(H,17,18);2-3H,1H3/p-1