(5R)-5-azaniumyl-5-(2,3-dihydro-1-benzofuran-5-yl)pentanoate

Systemtic Name: (5R)-5-azaniumyl-5-(2,3-dihydro-1-benzofuran-5-yl)pentanoate Openeye Name: (5R)-5-azaniumyl-5-(2,3-dihydrobenzofuran-5-yl)pentanoate CAS Name: (5R)-5-ammonio-5-(2,3-dihydrobenzofuran-5-yl)pentanoate IUPAC Name: (5R)-5-azaniumyl-5-(2,3-dihydro-1-benzofuran-5-yl)pentanoate Traditional Name: (5R)-5-ammonio-5-coumaran-5-yl-valerate Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(CCCC(=O)[O-])[NH3+]

Isomeric SMILES

C1COC2=C1C=C(C=C2)[C@@H](CCCC(=O)[O-])[NH3+]

InChI

InChI=1S/C13H17NO3/c14-11(2-1-3-13(15)16)9-4-5-12-10(8-9)6-7-17-12/h4-5,8,11H,1-3,6-7,14H2,(H,15,16)/t11-/m1/s1