2-[6-[2-methoxy-3-methyl-4-(phenethylamino)phenyl]pyridin-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[6-[2-methoxy-3-methyl-4-(phenethylamino)phenyl]pyridin-2-yl]isoindole-1,3-dione Openeye Name: 2-[6-[2-methoxy-3-methyl-4-(phenethylamino)phenyl]-2-pyridyl]isoindoline-1,3-dione CAS Name: 2-[6-[2-methoxy-3-methyl-4-(phenethylamino)phenyl]-2-pyridinyl]isoindole-1,3-dione IUPAC Name: 2-[6-[2-methoxy-3-methyl-4-(phenethylamino)phenyl]pyridin-2-yl]isoindole-1,3-dione Traditional Name: 2-[6-[2-methoxy-3-methyl-4-(phenethylamino)phenyl]-2-pyridyl]isoindoline-1,3-quinone Formula: C29H25N3O3 MolecularWeight: 463.5271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)C2=NC(=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)NCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=CC(=C1OC)C2=NC(=CC=C2)N3C(=O)C4=CC=CC=C4C3=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C29H25N3O3/c1-19-24(30-18-17-20-9-4-3-5-10-20)16-15-23(27(19)35-2)25-13-8-14-26(31-25)32-28(33)21-11-6-7-12-22(21)29(32)34/h3-16,30H,17-18H2,1-2H3