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2-azanyl-5-(1,3-benzodioxol-5-ylmethylamino)pentanoic acid

2-azanyl-5-(1,3-benzodioxol-5-ylmethylamino)pentanoic acid

Systemtic Name:2-azanyl-5-(1,3-benzodioxol-5-ylmethylamino)pentanoic acid
Openeye Name:2-amino-5-(1,3-benzodioxol-5-ylmethylamino)pentanoic acid
CAS Name:2-amino-5-(1,3-benzodioxol-5-ylmethylamino)pentanoic acid
IUPAC Name:2-amino-5-(1,3-benzodioxol-5-ylmethylamino)pentanoic acid
Traditional Name:2-amino-5-(piperonylamino)valeric acid
Formula: C13H18N2O4
MolecularWeight: 266.29302
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCCCC(C(=O)O)N


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCCCC(C(=O)O)N


InChI

InChI=1S/C13H18N2O4/c14-10(13(16)17)2-1-5-15-7-9-3-4-11-12(6-9)19-8-18-11/h3-4,6,10,15H,1-2,5,7-8,14H2,(H,16,17)


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