2-[4-(1-methoxy-2-methyl-propan-2-yl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-[4-(1-methoxy-2-methyl-propan-2-yl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-[4-(2-methoxy-1,1-dimethyl-ethyl)phenyl]-7-(4-pyridylmethylamino)isoindolin-1-one CAS Name: 2-[4-(1-methoxy-2-methylpropan-2-yl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-[4-(1-methoxy-2-methylpropan-2-yl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-[4-(2-methoxy-1,1-dimethyl-ethyl)phenyl]-7-(4-pyridylmethylamino)isoindolin-1-one Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC)C1=CC=C(C=C1)N2CC3=C(C2=O)C(=CC=C3)NCC4=CC=NC=C4

Isomeric SMILES

CC(C)(COC)C1=CC=C(C=C1)N2CC3=C(C2=O)C(=CC=C3)NCC4=CC=NC=C4

InChI

InChI=1S/C25H27N3O2/c1-25(2,17-30-3)20-7-9-21(10-8-20)28-16-19-5-4-6-22(23(19)24(28)29)27-15-18-11-13-26-14-12-18/h4-14,27H,15-17H2,1-3H3