[(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-[(4-dimethylaminophenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-[(4-dimethylaminophenyl)methyl]-methyl-azanium Openeye Name: [(1R)-2-(4-cyanoanilino)-1-methyl-2-oxo-ethyl]-[(4-dimethylaminophenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-[(4-dimethylaminophenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-(4-cyanoanilino)-1-oxopropan-2-yl]-[(4-dimethylaminophenyl)methyl]-methylazanium Traditional Name: [(1R)-2-(4-cyanoanilino)-2-keto-1-methyl-ethyl]-[4-(dimethylamino)benzyl]-methyl-ammonium Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)[NH+](C)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C#N)[NH+](C)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H24N4O/c1-15(20(25)22-18-9-5-16(13-21)6-10-18)24(4)14-17-7-11-19(12-8-17)23(2)3/h5-12,15H,14H2,1-4H3,(H,22,25)/p+1/t15-/m1/s1