[2-(hydroxymethyl)-2-methyl-3-(methylamino)propyl] benzoate

Systemtic Name: [2-(hydroxymethyl)-2-methyl-3-(methylamino)propyl] benzoate Openeye Name: [2-(hydroxymethyl)-2-methyl-3-(methylamino)propyl] benzoate CAS Name: benzoic acid [2-(hydroxymethyl)-2-methyl-3-(methylamino)propyl] ester IUPAC Name: [2-(hydroxymethyl)-2-methyl-3-(methylamino)propyl] benzoate Traditional Name: benzoic acid [3-hydroxy-2-methyl-2-(methylaminomethyl)propyl] ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC)(CO)COC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(CNC)(CO)COC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H19NO3/c1-13(9-15,8-14-2)10-17-12(16)11-6-4-3-5-7-11/h3-7,14-15H,8-10H2,1-2H3