4-[1-(4-butylphenyl)-1,2,3-triazol-4-yl]-6-propan-2-yl-benzene-1,3-diol

Systemtic Name: 4-[1-(4-butylphenyl)-1,2,3-triazol-4-yl]-6-propan-2-yl-benzene-1,3-diol Openeye Name: 4-[1-(4-butylphenyl)triazol-4-yl]-6-isopropyl-benzene-1,3-diol CAS Name: 4-[1-(4-butylphenyl)-4-triazolyl]-6-propan-2-ylbenzene-1,3-diol IUPAC Name: 4-[1-(4-butylphenyl)triazol-4-yl]-6-propan-2-ylbenzene-1,3-diol Traditional Name: 4-[1-(4-butylphenyl)triazol-4-yl]-6-isopropyl-resorcinol Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C=C(N=N2)C3=CC(=C(C=C3O)O)C(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C=C(N=N2)C3=CC(=C(C=C3O)O)C(C)C

InChI

InChI=1S/C21H25N3O2/c1-4-5-6-15-7-9-16(10-8-15)24-13-19(22-23-24)18-11-17(14(2)3)20(25)12-21(18)26/h7-14,25-26H,4-6H2,1-3H3