3-[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]benzenecarbonitrile

Systemtic Name: 3-[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-oxidanylidene-3,4-dihydroisoquinolin-5-yl]benzenecarbonitrile Openeye Name: 3-[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]benzonitrile CAS Name: 3-[2-[2-[(2R)-2-methyl-1-pyrrolidinyl]ethyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]benzonitrile IUPAC Name: 3-[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-oxo-3,4-dihydroisoquinolin-5-yl]benzonitrile Traditional Name: 3-[1-keto-2-[2-[(2R)-2-methylpyrrolidino]ethyl]-3,4-dihydroisoquinolin-5-yl]benzonitrile Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1CCN2CCC3=C(C=CC=C3C2=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C[C@@H]1CCCN1CCN2CCC3=C(C=CC=C3C2=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H25N3O/c1-17-5-4-11-25(17)13-14-26-12-10-21-20(8-3-9-22(21)23(26)27)19-7-2-6-18(15-19)16-24/h2-3,6-9,15,17H,4-5,10-14H2,1H3/t17-/m1/s1