N-(6-oxidanylhexyl)-11-oxidanylidene-[1,3]benzoxazolo[3,2-b]isoquinoline-3-carboxamide

Systemtic Name: N-(6-oxidanylhexyl)-11-oxidanylidene-[1,3]benzoxazolo[3,2-b]isoquinoline-3-carboxamide Openeye Name: N-(6-hydroxyhexyl)-11-oxo-[1,3]benzoxazolo[3,2-b]isoquinoline-3-carboxamide CAS Name: N-(6-hydroxyhexyl)-11-oxo-[1,3]benzoxazolo[3,2-b]isoquinoline-3-carboxamide IUPAC Name: N-(6-hydroxyhexyl)-11-oxo-[1,3]benzoxazolo[3,2-b]isoquinoline-3-carboxamide Traditional Name: N-(6-hydroxyhexyl)-11-keto-[1,3]benzoxazol[3,2-b]isoquinoline-3-carboxamide Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3N(C2=O)C4=C(O3)C=C(C=C4)C(=O)NCCCCCCO

Isomeric SMILES

C1=CC=C2C(=C1)C=C3N(C2=O)C4=C(O3)C=C(C=C4)C(=O)NCCCCCCO

InChI

InChI=1S/C22H22N2O4/c25-12-6-2-1-5-11-23-21(26)16-9-10-18-19(13-16)28-20-14-15-7-3-4-8-17(15)22(27)24(18)20/h3-4,7-10,13-14,25H,1-2,5-6,11-12H2,(H,23,26)