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

Systemtic Name: N-hexylhexan-1-amine; 2-(2-oxidanylidene-3-phenyl-1-benzofuran-6-ylidene)indene-1,3-dione Openeye Name: N-hexylhexan-1-amine; 2-(2-oxo-3-phenyl-benzofuran-6-ylidene)indane-1,3-dione CAS Name: N-hexyl-1-hexanamine; 2-(2-oxo-3-phenyl-6-benzofuranylidene)indene-1,3-dione IUPAC Name: N-hexylhexan-1-amine; 2-(2-oxo-3-phenyl-1-benzofuran-6-ylidene)indene-1,3-dione Traditional Name: dihexylamine; 2-(2-keto-3-phenyl-benzofuran-6-ylidene)indane-1,3-quinone Formula: C35H39NO4 MolecularWeight: 537.68846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H12O4.C12H27N/c24-21-15-8-4-5-9-16(15)22(25)20(21)14-10-11-17-18(12-14)27-23(26)19(17)13-6-2-1-3-7-13;1-3-5-7-9-11-13-12-10-8-6-4-2/h1-12H;13H,3-12H2,1-2H3