(2S)-2-[(4-dimethylaminophenyl)methyl]-3-methoxy-propanoate

Systemtic Name: (2S)-2-[(4-dimethylaminophenyl)methyl]-3-methoxy-propanoate Openeye Name: (2S)-2-[(4-dimethylaminophenyl)methyl]-3-methoxy-propanoate CAS Name: (2S)-2-[(4-dimethylaminophenyl)methyl]-3-methoxypropanoate IUPAC Name: (2S)-2-[(4-dimethylaminophenyl)methyl]-3-methoxypropanoate Traditional Name: (2S)-2-[4-(dimethylamino)benzyl]-3-methoxy-propionate Formula: C13H18NO3- MolecularWeight: 236.28692

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CC(COC)C(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[C@@H](COC)C(=O)[O-]

InChI

InChI=1S/C13H19NO3/c1-14(2)12-6-4-10(5-7-12)8-11(9-17-3)13(15)16/h4-7,11H,8-9H2,1-3H3,(H,15,16)/p-1/t11-/m0/s1