(4-cyanophenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium

Systemtic Name: (4-cyanophenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium Openeye Name: (4-cyanophenyl)methyl-[(1S)-2-methoxy-1-methyl-ethyl]ammonium CAS Name: (4-cyanophenyl)methyl-[(2S)-1-methoxypropan-2-yl]ammonium IUPAC Name: (4-cyanophenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium Traditional Name: (4-cyanobenzyl)-[(1S)-2-methoxy-1-methyl-ethyl]ammonium Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)[NH2+]CC1=CC=C(C=C1)C#N

Isomeric SMILES

C[C@@H](COC)[NH2+]CC1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H16N2O/c1-10(9-15-2)14-8-12-5-3-11(7-13)4-6-12/h3-6,10,14H,8-9H2,1-2H3/p+1/t10-/m0/s1