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(1S,2R)-2-(1,3-benzodioxol-5-ylamino)cyclohexane-1-carboxylic acid

(1S,2R)-2-(1,3-benzodioxol-5-ylamino)cyclohexane-1-carboxylic acid

Systemtic Name:(1S,2R)-2-(1,3-benzodioxol-5-ylamino)cyclohexane-1-carboxylic acid
Openeye Name:(1S,2R)-2-(1,3-benzodioxol-5-ylamino)cyclohexanecarboxylic acid
CAS Name:(1S,2R)-2-(1,3-benzodioxol-5-ylamino)-1-cyclohexanecarboxylic acid
IUPAC Name:(1S,2R)-2-(1,3-benzodioxol-5-ylamino)cyclohexane-1-carboxylic acid
Traditional Name:(1S,2R)-2-(1,3-benzodioxol-5-ylamino)cyclohexanecarboxylic acid
Formula: C14H17NO4
MolecularWeight: 263.28908
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)O)NC2=CC3=C(C=C2)OCO3


Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)O)NC2=CC3=C(C=C2)OCO3


InChI

InChI=1S/C14H17NO4/c16-14(17)10-3-1-2-4-11(10)15-9-5-6-12-13(7-9)19-8-18-12/h5-7,10-11,15H,1-4,8H2,(H,16,17)/t10-,11+/m0/s1


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