4-(3-fluorophenyl)-6-methoxy-1-oxidanylidene-2-(2-oxidanylideneethyl)isoquinoline-3-carbonitrile

Systemtic Name: 4-(3-fluorophenyl)-6-methoxy-1-oxidanylidene-2-(2-oxidanylideneethyl)isoquinoline-3-carbonitrile Openeye Name: 4-(3-fluorophenyl)-6-methoxy-1-oxo-2-(2-oxoethyl)isoquinoline-3-carbonitrile CAS Name: 4-(3-fluorophenyl)-6-methoxy-1-oxo-2-(2-oxoethyl)-3-isoquinolinecarbonitrile IUPAC Name: 4-(3-fluorophenyl)-6-methoxy-1-oxo-2-(2-oxoethyl)isoquinoline-3-carbonitrile Traditional Name: 4-(3-fluorophenyl)-1-keto-2-(2-ketoethyl)-6-methoxy-isoquinoline-3-carbonitrile Formula: C19H13FN2O3 MolecularWeight: 336.316523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC(=CC=C3)F)C#N)CC=O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC(=CC=C3)F)C#N)CC=O

InChI

InChI=1S/C19H13FN2O3/c1-25-14-5-6-15-16(10-14)18(12-3-2-4-13(20)9-12)17(11-21)22(7-8-23)19(15)24/h2-6,8-10H,7H2,1H3