methyl (3R,4R)-4-azanyl-3-(1,3-benzodioxol-5-yl)-5-oxidanyl-pentanoate hydrochloride

Systemtic Name: methyl (3R,4R)-4-azanyl-3-(1,3-benzodioxol-5-yl)-5-oxidanyl-pentanoate hydrochloride Openeye Name: methyl (3R,4R)-4-amino-3-(1,3-benzodioxol-5-yl)-5-hydroxy-pentanoate hydrochloride CAS Name: (3R,4R)-4-amino-3-(1,3-benzodioxol-5-yl)-5-hydroxypentanoic acid methyl ester hydrochloride IUPAC Name: methyl (3R,4R)-4-amino-3-(1,3-benzodioxol-5-yl)-5-hydroxypentanoate hydrochloride Traditional Name: (3R,4R)-4-amino-3-(1,3-benzodioxol-5-yl)-5-hydroxy-valeric acid methyl ester hydrochloride Formula: C13H18ClNO5 MolecularWeight: 303.73872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC2=C(C=C1)OCO2)C(CO)N.Cl

Isomeric SMILES

COC(=O)C[C@H](C1=CC2=C(C=C1)OCO2)[C@H](CO)N.Cl

InChI

InChI=1S/C13H17NO5.ClH/c1-17-13(16)5-9(10(14)6-15)8-2-3-11-12(4-8)19-7-18-11;/h2-4,9-10,15H,5-7,14H2,1H3;1H/t9-,10+;/m1./s1