N-[(2S)-octan-2-yl]-11-oxidanylidene-[1,3]benzoxazolo[3,2-b]isoquinoline-2-carboxamide

Systemtic Name: N-[(2S)-octan-2-yl]-11-oxidanylidene-[1,3]benzoxazolo[3,2-b]isoquinoline-2-carboxamide Openeye Name: N-[(1S)-1-methylheptyl]-11-oxo-[1,3]benzoxazolo[3,2-b]isoquinoline-2-carboxamide CAS Name: N-[(2S)-octan-2-yl]-11-oxo-[1,3]benzoxazolo[3,2-b]isoquinoline-2-carboxamide IUPAC Name: N-[(2S)-octan-2-yl]-11-oxo-[1,3]benzoxazolo[3,2-b]isoquinoline-2-carboxamide Traditional Name: 11-keto-N-[(1S)-1-methylheptyl]-[1,3]benzoxazol[3,2-b]isoquinoline-2-carboxamide Formula: C24H26N2O3 MolecularWeight: 390.47484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)C1=CC2=C(C=C1)OC3=CC4=CC=CC=C4C(=O)N32

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)C1=CC2=C(C=C1)OC3=CC4=CC=CC=C4C(=O)N32

InChI

InChI=1S/C24H26N2O3/c1-3-4-5-6-9-16(2)25-23(27)18-12-13-21-20(14-18)26-22(29-21)15-17-10-7-8-11-19(17)24(26)28/h7-8,10-16H,3-6,9H2,1-2H3,(H,25,27)/t16-/m0/s1