1-deuterio-2-(4-methoxyphenyl)carbonyl-isoquinoline-1-carbonitrile

Systemtic Name: 1-deuterio-2-(4-methoxyphenyl)carbonyl-isoquinoline-1-carbonitrile Openeye Name: 1-deuterio-2-(4-methoxybenzoyl)isoquinoline-1-carbonitrile CAS Name: 1-deuterio-2-[(4-methoxyphenyl)-oxomethyl]-1-isoquinolinecarbonitrile IUPAC Name: 1-deuterio-2-(4-methoxybenzoyl)isoquinoline-1-carbonitrile Traditional Name: 1-deuterio-2-p-anisoyl-isoquinoline-1-carbonitrile Formula: C18H14N2O2 MolecularWeight: 291.322122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2C#N

Isomeric SMILES

[2H]C1(C2=CC=CC=C2C=CN1C(=O)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C18H14N2O2/c1-22-15-8-6-14(7-9-15)18(21)20-11-10-13-4-2-3-5-16(13)17(20)12-19/h2-11,17H,1H3/i17D