2-[[(S)-cyano-(3-propoxyphenyl)methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(S)-cyano-(3-propoxyphenyl)methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(S)-cyano-(3-propoxyphenyl)methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(S)-cyano-(3-propoxyphenyl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(S)-cyano-(3-propoxyphenyl)methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(S)-cyano-(3-propoxyphenyl)methyl]amino]ethyl-dimethyl-ammonium Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(C#N)NCC[NH+](C)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@@H](C#N)NCC[NH+](C)C

InChI

InChI=1S/C15H23N3O/c1-4-10-19-14-7-5-6-13(11-14)15(12-16)17-8-9-18(2)3/h5-7,11,15,17H,4,8-10H2,1-3H3/p+1/t15-/m1/s1