2-cyclopropyl-4-(3-fluorophenyl)-1-oxidanylidene-6-prop-2-enoxy-isoquinoline-3-carbonitrile

Systemtic Name: 2-cyclopropyl-4-(3-fluorophenyl)-1-oxidanylidene-6-prop-2-enoxy-isoquinoline-3-carbonitrile Openeye Name: 6-allyloxy-2-cyclopropyl-4-(3-fluorophenyl)-1-oxo-isoquinoline-3-carbonitrile CAS Name: 2-cyclopropyl-4-(3-fluorophenyl)-1-oxo-6-prop-2-enoxy-3-isoquinolinecarbonitrile IUPAC Name: 2-cyclopropyl-4-(3-fluorophenyl)-1-oxo-6-prop-2-enoxyisoquinoline-3-carbonitrile Traditional Name: 6-allyloxy-2-cyclopropyl-4-(3-fluorophenyl)-1-keto-isoquinoline-3-carbonitrile Formula: C22H17FN2O2 MolecularWeight: 360.380983

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC(=CC=C3)F)C#N)C4CC4

Isomeric SMILES

C=CCOC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC(=CC=C3)F)C#N)C4CC4

InChI

InChI=1S/C22H17FN2O2/c1-2-10-27-17-8-9-18-19(12-17)21(14-4-3-5-15(23)11-14)20(13-24)25(22(18)26)16-6-7-16/h2-5,8-9,11-12,16H,1,6-7,10H2