3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-2-(4-methoxyphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C3=C(C2=O)CCCC3)CC(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C3=C(C2=O)CCCC3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C23H30N2O3/c1-28-18-12-10-17(11-13-18)25-21(19-8-4-5-9-20(19)23(25)27)16-22(26)24-14-6-2-3-7-15-24/h10-13,21H,2-9,14-16H2,1H3