2-[5-(3,4-dibutoxyphenyl)-3-methyl-2H-1,2,3,4-tetrazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-(3,4-dibutoxyphenyl)-3-methyl-2H-1,2,3,4-tetrazol-4-yl]ethanoic acid Openeye Name: 2-[5-(3,4-dibutoxyphenyl)-3-methyl-2H-tetrazol-4-yl]acetic acid CAS Name: 2-[5-(3,4-dibutoxyphenyl)-3-methyl-2H-tetrazol-4-yl]acetic acid IUPAC Name: 2-[5-(3,4-dibutoxyphenyl)-3-methyl-2H-tetrazol-4-yl]acetic acid Traditional Name: 2-[5-(3,4-dibutoxyphenyl)-3-methyl-2H-tetrazol-4-yl]acetic acid Formula: C18H28N4O4 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=NNN(N2CC(=O)O)C)OCCCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=NNN(N2CC(=O)O)C)OCCCC

InChI

InChI=1S/C18H28N4O4/c1-4-6-10-25-15-9-8-14(12-16(15)26-11-7-5-2)18-19-20-21(3)22(18)13-17(23)24/h8-9,12,20H,4-7,10-11,13H2,1-3H3,(H,23,24)