5-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-(2,3-dihydroindol-1-ylmethyl)pyran-4-one

Systemtic Name: 5-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-(2,3-dihydroindol-1-ylmethyl)pyran-4-one Openeye Name: 5-[2-(azepan-1-yl)-2-oxo-ethoxy]-2-(indolin-1-ylmethyl)pyran-4-one CAS Name: 5-[2-(1-azepanyl)-2-oxoethoxy]-2-(2,3-dihydroindol-1-ylmethyl)-4-pyranone IUPAC Name: 5-[2-(azepan-1-yl)-2-oxoethoxy]-2-(2,3-dihydroindol-1-ylmethyl)pyran-4-one Traditional Name: 5-[2-(azepan-1-yl)-2-keto-ethoxy]-2-(indolin-1-ylmethyl)pyran-4-one Formula: C22H26N2O4 MolecularWeight: 382.45284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=COC(=CC2=O)CN3CCC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=COC(=CC2=O)CN3CCC4=CC=CC=C43

InChI

InChI=1S/C22H26N2O4/c25-20-13-18(14-24-12-9-17-7-3-4-8-19(17)24)27-15-21(20)28-16-22(26)23-10-5-1-2-6-11-23/h3-4,7-8,13,15H,1-2,5-6,9-12,14,16H2