2-ethyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]amino]-3H-isoindol-1-one

Systemtic Name: 2-ethyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]amino]-3H-isoindol-1-one Openeye Name: 2-ethyl-3-[4-[2-(1-piperidyl)ethoxy]anilino]isoindolin-1-one CAS Name: 2-ethyl-3-[4-[2-(1-piperidinyl)ethoxy]anilino]-3H-isoindol-1-one IUPAC Name: 2-ethyl-3-[4-(2-piperidin-1-ylethoxy)anilino]-3H-isoindol-1-one Traditional Name: 2-ethyl-3-[4-(2-piperidinoethoxy)anilino]isoindolin-1-one Formula: C23H29N3O2 MolecularWeight: 379.49526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4

Isomeric SMILES

CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4

InChI

InChI=1S/C23H29N3O2/c1-2-26-22(20-8-4-5-9-21(20)23(26)27)24-18-10-12-19(13-11-18)28-17-16-25-14-6-3-7-15-25/h4-5,8-13,22,24H,2-3,6-7,14-17H2,1H3