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2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-1,2,3-triazol-4-yl]benzoic acid

2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-1,2,3-triazol-4-yl]benzoic acid

Systemtic Name:2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-1,2,3-triazol-4-yl]benzoic acid
Openeye Name:2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-triazol-4-yl]benzoic acid
CAS Name:2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-triazol-4-yl]benzoic acid
IUPAC Name:2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-triazol-4-yl]benzoic acid
Traditional Name:2-methoxy-5-[5-(7-methoxy-1,3-benzodioxol-5-yl)-2H-triazol-4-yl]benzoic acid
Formula: C18H15N3O6
MolecularWeight: 369.3282
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNN=C2C3=CC4=C(C(=C3)OC)OCO4)C(=O)O


Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNN=C2C3=CC4=C(C(=C3)OC)OCO4)C(=O)O


InChI

InChI=1S/C18H15N3O6/c1-24-12-4-3-9(5-11(12)18(22)23)15-16(20-21-19-15)10-6-13(25-2)17-14(7-10)26-8-27-17/h3-7H,8H2,1-2H3,(H,22,23)(H,19,20,21)


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