2-[1-(dimethylamino)-2-oxidanylidene-hexadecan-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(dimethylamino)-2-oxidanylidene-hexadecan-3-yl]isoindole-1,3-dione Openeye Name: 2-[1-[2-(dimethylamino)acetyl]tetradecyl]isoindoline-1,3-dione CAS Name: 2-[1-(dimethylamino)-2-oxohexadecan-3-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(dimethylamino)-2-oxohexadecan-3-yl]isoindole-1,3-dione Traditional Name: 2-[1-[2-(dimethylamino)acetyl]tetradecyl]isoindoline-1,3-quinone Formula: C26H40N2O3 MolecularWeight: 428.6074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(=O)CN(C)C)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCCCCCCCCCCCC(C(=O)CN(C)C)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C26H40N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-19-23(24(29)20-27(2)3)28-25(30)21-17-15-16-18-22(21)26(28)31/h15-18,23H,4-14,19-20H2,1-3H3