2-[[(S)-(4-tert-butylphenyl)-cyano-methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(S)-(4-tert-butylphenyl)-cyano-methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(S)-(4-tert-butylphenyl)-cyano-methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(S)-(4-tert-butylphenyl)-cyanomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(S)-(4-tert-butylphenyl)-cyanomethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(S)-(4-tert-butylphenyl)-cyano-methyl]amino]ethyl-dimethyl-ammonium Formula: C16H26N3+ MolecularWeight: 260.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C#N)NCC[NH+](C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@@H](C#N)NCC[NH+](C)C

InChI

InChI=1S/C16H25N3/c1-16(2,3)14-8-6-13(7-9-14)15(12-17)18-10-11-19(4)5/h6-9,15,18H,10-11H2,1-5H3/p+1/t15-/m1/s1