N-hexadecylhexadecan-1-amine; 2-(2-oxidanylidene-3-phenyl-1-benzofuran-6-ylidene)indene-1,3-dione

Systemtic Name: N-hexadecylhexadecan-1-amine; 2-(2-oxidanylidene-3-phenyl-1-benzofuran-6-ylidene)indene-1,3-dione Openeye Name: N-hexadecylhexadecan-1-amine; 2-(2-oxo-3-phenyl-benzofuran-6-ylidene)indane-1,3-dione CAS Name: N-hexadecyl-1-hexadecanamine; 2-(2-oxo-3-phenyl-6-benzofuranylidene)indene-1,3-dione IUPAC Name: N-hexadecylhexadecan-1-amine; 2-(2-oxo-3-phenyl-1-benzofuran-6-ylidene)indene-1,3-dione Traditional Name: dicetylamine; 2-(2-keto-3-phenyl-benzofuran-6-ylidene)indane-1,3-quinone Formula: C55H79NO4 MolecularWeight: 818.22006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCCCCCCCCCCCCCCCC.C1=CC=C(C=C1)C2=C3C=CC(=C4C(=O)C5=CC=CC=C5C4=O)C=C3OC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCCNCCCCCCCCCCCCCCCC.C1=CC=C(C=C1)C2=C3C=CC(=C4C(=O)C5=CC=CC=C5C4=O)C=C3OC2=O

InChI

InChI=1S/C32H67N.C23H12O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;24-21-15-8-4-5-9-16(15)22(25)20(21)14-10-11-17-18(12-14)27-23(26)19(17)13-6-2-1-3-7-13/h33H,3-32H2,1-2H3;1-12H