(E)-3-[4-(4-pentyl-1,2,3-triazol-1-yl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-pentyl-1,2,3-triazol-1-yl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-pentyltriazol-1-yl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(4-pentyl-1-triazolyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(4-pentyltriazol-1-yl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-amyltriazol-1-yl)phenyl]acrylic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN(N=N1)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CCCCCC1=CN(N=N1)C2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C16H19N3O2/c1-2-3-4-5-14-12-19(18-17-14)15-9-6-13(7-10-15)8-11-16(20)21/h6-12H,2-5H2,1H3,(H,20,21)/b11-8+