methyl 4-[(2-oxidanylpropylamino)methyl]benzoate

Systemtic Name: methyl 4-[(2-oxidanylpropylamino)methyl]benzoate Openeye Name: methyl 4-[(2-hydroxypropylamino)methyl]benzoate CAS Name: 4-[(2-hydroxypropylamino)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-hydroxypropylamino)methyl]benzoate Traditional Name: 4-[(2-hydroxypropylamino)methyl]benzoic acid methyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC1=CC=C(C=C1)C(=O)OC)O

Isomeric SMILES

CC(CNCC1=CC=C(C=C1)C(=O)OC)O

InChI

InChI=1S/C12H17NO3/c1-9(14)7-13-8-10-3-5-11(6-4-10)12(15)16-2/h3-6,9,13-14H,7-8H2,1-2H3