(4R)-4-azaniumyl-4-(4-propan-2-yloxyphenyl)butanoate

Systemtic Name: (4R)-4-azaniumyl-4-(4-propan-2-yloxyphenyl)butanoate Openeye Name: (4R)-4-azaniumyl-4-(4-isopropoxyphenyl)butanoate CAS Name: (4R)-4-ammonio-4-(4-propan-2-yloxyphenyl)butanoate IUPAC Name: (4R)-4-azaniumyl-4-(4-propan-2-yloxyphenyl)butanoate Traditional Name: (4R)-4-ammonio-4-(4-isopropoxyphenyl)butyrate Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(CCC(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@@H](CCC(=O)[O-])[NH3+]

InChI

InChI=1S/C13H19NO3/c1-9(2)17-11-5-3-10(4-6-11)12(14)7-8-13(15)16/h3-6,9,12H,7-8,14H2,1-2H3,(H,15,16)/t12-/m1/s1