4-[(2-prop-2-ynoxyphenyl)methylidene]-2-(pyridin-2-ylmethyl)isoquinoline-1,3-dione

Systemtic Name: 4-[(2-prop-2-ynoxyphenyl)methylidene]-2-(pyridin-2-ylmethyl)isoquinoline-1,3-dione Openeye Name: 4-[(2-prop-2-ynoxyphenyl)methylene]-2-(2-pyridylmethyl)isoquinoline-1,3-dione CAS Name: 4-[(2-prop-2-ynoxyphenyl)methylidene]-2-(2-pyridinylmethyl)isoquinoline-1,3-dione IUPAC Name: 4-[(2-prop-2-ynoxyphenyl)methylidene]-2-(pyridin-2-ylmethyl)isoquinoline-1,3-dione Traditional Name: 4-(2-propargyloxybenzylidene)-2-(2-pyridylmethyl)isoquinoline-1,3-quinone Formula: C25H18N2O3 MolecularWeight: 394.42202

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC=C1C=C2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=N4

Isomeric SMILES

C#CCOC1=CC=CC=C1C=C2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=CC=N4

InChI

InChI=1S/C25H18N2O3/c1-2-15-30-23-13-6-3-9-18(23)16-22-20-11-4-5-12-21(20)24(28)27(25(22)29)17-19-10-7-8-14-26-19/h1,3-14,16H,15,17H2