3-[3-azanyl-1-(4-fluorophenyl)-5-methoxy-2-oxidanylidene-indol-3-yl]propanenitrile

Systemtic Name: 3-[3-azanyl-1-(4-fluorophenyl)-5-methoxy-2-oxidanylidene-indol-3-yl]propanenitrile Openeye Name: 3-[3-amino-1-(4-fluorophenyl)-5-methoxy-2-oxo-indolin-3-yl]propanenitrile CAS Name: 3-[3-amino-1-(4-fluorophenyl)-5-methoxy-2-oxo-3-indolyl]propanenitrile IUPAC Name: 3-[3-amino-1-(4-fluorophenyl)-5-methoxy-2-oxoindol-3-yl]propanenitrile Traditional Name: 3-[3-amino-1-(4-fluorophenyl)-2-keto-5-methoxy-indolin-3-yl]propionitrile Formula: C18H16FN3O2 MolecularWeight: 325.336943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=O)C2(CCC#N)N)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=O)C2(CCC#N)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN3O2/c1-24-14-7-8-16-15(11-14)18(21,9-2-10-20)17(23)22(16)13-5-3-12(19)4-6-13/h3-8,11H,2,9,21H2,1H3