methyl 3-[(2R)-2-oxidanyl-3-(3-propan-2-yloxypropylamino)propoxy]benzoate

Systemtic Name: methyl 3-[(2R)-2-oxidanyl-3-(3-propan-2-yloxypropylamino)propoxy]benzoate Openeye Name: methyl 3-[(2R)-2-hydroxy-3-(3-isopropoxypropylamino)propoxy]benzoate CAS Name: 3-[(2R)-2-hydroxy-3-(3-propan-2-yloxypropylamino)propoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[(2R)-2-hydroxy-3-(3-propan-2-yloxypropylamino)propoxy]benzoate Traditional Name: 3-[(2R)-2-hydroxy-3-(3-isopropoxypropylamino)propoxy]benzoic acid methyl ester Formula: C17H27NO5 MolecularWeight: 325.39998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNCC(COC1=CC=CC(=C1)C(=O)OC)O

Isomeric SMILES

CC(C)OCCCNC[C@H](COC1=CC=CC(=C1)C(=O)OC)O

InChI

InChI=1S/C17H27NO5/c1-13(2)22-9-5-8-18-11-15(19)12-23-16-7-4-6-14(10-16)17(20)21-3/h4,6-7,10,13,15,18-19H,5,8-9,11-12H2,1-3H3/t15-/m1/s1