(3Z)-5-(hydroxymethyl)-3-[1-(phenethylamino)hexadecylidene]oxolane-2,4-dione

Systemtic Name: (3Z)-5-(hydroxymethyl)-3-[1-(phenethylamino)hexadecylidene]oxolane-2,4-dione Openeye Name: (3Z)-5-(hydroxymethyl)-3-[1-(phenethylamino)hexadecylidene]tetrahydrofuran-2,4-dione CAS Name: (3Z)-5-(hydroxymethyl)-3-[1-(phenethylamino)hexadecylidene]oxolane-2,4-dione IUPAC Name: (3Z)-5-(hydroxymethyl)-3-[1-(phenethylamino)hexadecylidene]oxolane-2,4-dione Traditional Name: (3Z)-5-methylol-3-[1-(phenethylamino)hexadecylidene]tetrahydrofuran-2,4-quinone Formula: C29H45NO4 MolecularWeight: 471.6719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=C1C(=O)C(OC1=O)CO)NCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC/C(=C/1\C(=O)C(OC1=O)CO)/NCCC2=CC=CC=C2

InChI

InChI=1S/C29H45NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-25(27-28(32)26(23-31)34-29(27)33)30-22-21-24-18-15-14-16-19-24/h14-16,18-19,26,30-31H,2-13,17,20-23H2,1H3/b27-25-