(4Z)-4-[(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylidene]-2-(pyridin-2-ylmethyl)isoquinoline-1,3-dione

Systemtic Name: (4Z)-4-[(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylidene]-2-(pyridin-2-ylmethyl)isoquinoline-1,3-dione Openeye Name: (4Z)-4-[(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methylene]-2-(2-pyridylmethyl)isoquinoline-1,3-dione CAS Name: (4Z)-4-[(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)methylidene]-2-(2-pyridinylmethyl)isoquinoline-1,3-dione IUPAC Name: (4Z)-4-[(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)methylidene]-2-(pyridin-2-ylmethyl)isoquinoline-1,3-dione Traditional Name: (4Z)-4-[(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methylene]-2-(2-pyridylmethyl)isoquinoline-1,3-quinone Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=C2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=C\2/C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=N4

InChI

InChI=1S/C25H25N3O2/c1-16(2)28-17(3)13-19(18(28)4)14-23-21-10-5-6-11-22(21)24(29)27(25(23)30)15-20-9-7-8-12-26-20/h5-14,16H,15H2,1-4H3/b23-14-