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

Systemtic Name: 2-methyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]amino]-3H-isoindol-1-one Openeye Name: 2-methyl-3-[4-[2-(1-piperidyl)ethoxy]anilino]isoindolin-1-one CAS Name: 2-methyl-3-[4-[2-(1-piperidinyl)ethoxy]anilino]-3H-isoindol-1-one IUPAC Name: 2-methyl-3-[4-(2-piperidin-1-ylethoxy)anilino]-3H-isoindol-1-one Traditional Name: 2-methyl-3-[4-(2-piperidinoethoxy)anilino]isoindolin-1-one Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4

Isomeric SMILES

CN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4

InChI

InChI=1S/C22H27N3O2/c1-24-21(19-7-3-4-8-20(19)22(24)26)23-17-9-11-18(12-10-17)27-16-15-25-13-5-2-6-14-25/h3-4,7-12,21,23H,2,5-6,13-16H2,1H3