(3Z)-5-(hydroxymethyl)-3-(1-pyrrolidin-1-ylhexadecylidene)oxolane-2,4-dione

Systemtic Name: (3Z)-5-(hydroxymethyl)-3-(1-pyrrolidin-1-ylhexadecylidene)oxolane-2,4-dione Openeye Name: (3Z)-5-(hydroxymethyl)-3-(1-pyrrolidin-1-ylhexadecylidene)tetrahydrofuran-2,4-dione CAS Name: (3Z)-5-(hydroxymethyl)-3-[1-(1-pyrrolidinyl)hexadecylidene]oxolane-2,4-dione IUPAC Name: (3Z)-5-(hydroxymethyl)-3-(1-pyrrolidin-1-ylhexadecylidene)oxolane-2,4-dione Traditional Name: (3Z)-5-methylol-3-(1-pyrrolidinohexadecylidene)tetrahydrofuran-2,4-quinone Formula: C25H43NO4 MolecularWeight: 421.61322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=C1C(=O)C(OC1=O)CO)N2CCCC2

Isomeric SMILES

CCCCCCCCCCCCCCC/C(=C/1\C(=O)C(OC1=O)CO)/N2CCCC2

InChI

InChI=1S/C25H43NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-21(26-18-15-16-19-26)23-24(28)22(20-27)30-25(23)29/h22,27H,2-20H2,1H3/b23-21-