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

Systemtic Name: (4-methoxycarbonylphenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium Openeye Name: (4-methoxycarbonylphenyl)methyl-[(1S)-2-methoxy-1-methyl-ethyl]ammonium CAS Name: (4-methoxycarbonylphenyl)methyl-[(2S)-1-methoxypropan-2-yl]ammonium IUPAC Name: (4-methoxycarbonylphenyl)methyl-[(2S)-1-methoxypropan-2-yl]azanium Traditional Name: (4-carbomethoxybenzyl)-[(1S)-2-methoxy-1-methyl-ethyl]ammonium Formula: C13H20NO3+ MolecularWeight: 238.3028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)[NH2+]CC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

C[C@@H](COC)[NH2+]CC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C13H19NO3/c1-10(9-16-2)14-8-11-4-6-12(7-5-11)13(15)17-3/h4-7,10,14H,8-9H2,1-3H3/p+1/t10-/m0/s1