4-[(2Z)-2-[6-chloranyl-7-(dimethylamino)-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene]ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[(2Z)-2-[6-chloranyl-7-(dimethylamino)-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene]ethanoyl]benzenecarbonitrile Openeye Name: 4-[(2Z)-2-[6-chloro-7-(dimethylamino)-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene]acetyl]benzonitrile CAS Name: 4-[(2Z)-2-[6-chloro-7-(dimethylamino)-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-oxoethyl]benzonitrile IUPAC Name: 4-[(2Z)-2-[6-chloro-7-(dimethylamino)-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene]acetyl]benzonitrile Traditional Name: 4-[(2Z)-2-[6-chloro-7-(dimethylamino)-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene]acetyl]benzonitrile Formula: C22H22ClN3O MolecularWeight: 379.88258

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=CC(=O)C3=CC=C(C=C3)C#N)N1)N(C)C)Cl)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2/C(=C/C(=O)C3=CC=C(C=C3)C#N)/N1)N(C)C)Cl)C

InChI

InChI=1S/C22H22ClN3O/c1-22(2)12-16-9-18(23)20(26(3)4)10-17(16)19(25-22)11-21(27)15-7-5-14(13-24)6-8-15/h5-11,25H,12H2,1-4H3/b19-11-