butyl (E)-3-[5-(4-methylphenyl)-3-octyl-1,2,3-triazol-4-yl]prop-2-enoate

Systemtic Name: butyl (E)-3-[5-(4-methylphenyl)-3-octyl-1,2,3-triazol-4-yl]prop-2-enoate Openeye Name: butyl (E)-3-[3-octyl-5-(p-tolyl)triazol-4-yl]prop-2-enoate CAS Name: (E)-3-[5-(4-methylphenyl)-3-octyl-4-triazolyl]-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-[5-(4-methylphenyl)-3-octyltriazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[3-octyl-5-(p-tolyl)triazol-4-yl]acrylic acid butyl ester Formula: C24H35N3O2 MolecularWeight: 397.5536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=C(N=N1)C2=CC=C(C=C2)C)C=CC(=O)OCCCC

Isomeric SMILES

CCCCCCCCN1C(=C(N=N1)C2=CC=C(C=C2)C)/C=C/C(=O)OCCCC

InChI

InChI=1S/C24H35N3O2/c1-4-6-8-9-10-11-18-27-22(16-17-23(28)29-19-7-5-2)24(25-26-27)21-14-12-20(3)13-15-21/h12-17H,4-11,18-19H2,1-3H3/b17-16+