4-(3-fluorophenyl)-2-[2-[2-hydroxyethyl(methyl)amino]ethyl]-6-methoxy-1-oxidanylidene-isoquinoline-3-carbonitrile

Systemtic Name: 4-(3-fluorophenyl)-2-[2-[2-hydroxyethyl(methyl)amino]ethyl]-6-methoxy-1-oxidanylidene-isoquinoline-3-carbonitrile Openeye Name: 4-(3-fluorophenyl)-2-[2-[2-hydroxyethyl(methyl)amino]ethyl]-6-methoxy-1-oxo-isoquinoline-3-carbonitrile CAS Name: 4-(3-fluorophenyl)-2-[2-[2-hydroxyethyl(methyl)amino]ethyl]-6-methoxy-1-oxo-3-isoquinolinecarbonitrile IUPAC Name: 4-(3-fluorophenyl)-2-[2-[2-hydroxyethyl(methyl)amino]ethyl]-6-methoxy-1-oxoisoquinoline-3-carbonitrile Traditional Name: 4-(3-fluorophenyl)-2-[2-[2-hydroxyethyl(methyl)amino]ethyl]-1-keto-6-methoxy-isoquinoline-3-carbonitrile Formula: C22H22FN3O3 MolecularWeight: 395.426783

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC(=CC=C3)F)C#N)CCO

Isomeric SMILES

CN(CCN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC(=CC=C3)F)C#N)CCO

InChI

InChI=1S/C22H22FN3O3/c1-25(10-11-27)8-9-26-20(14-24)21(15-4-3-5-16(23)12-15)19-13-17(29-2)6-7-18(19)22(26)28/h3-7,12-13,27H,8-11H2,1-2H3