[(1S)-2-[(4-dimethylaminophenyl)methylamino]-1-(4-methylphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-dimethylaminophenyl)methylamino]-1-(4-methylphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-dimethylaminophenyl)methylamino]-1-(p-tolyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[(4-dimethylaminophenyl)methylamino]-1-(4-methylphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-dimethylaminophenyl)methylamino]-1-(4-methylphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[[4-(dimethylamino)benzyl]amino]-1-(p-tolyl)ethyl]-dimethyl-ammonium Formula: C20H30N3+ MolecularWeight: 312.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNCC2=CC=C(C=C2)N(C)C)[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](CNCC2=CC=C(C=C2)N(C)C)[NH+](C)C

InChI

InChI=1S/C20H29N3/c1-16-6-10-18(11-7-16)20(23(4)5)15-21-14-17-8-12-19(13-9-17)22(2)3/h6-13,20-21H,14-15H2,1-5H3/p+1/t20-/m1/s1