(1-propyl-1,2,3,4-tetrazol-5-yl)methyl (E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl (E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoate Openeye Name: (1-propyltetrazol-5-yl)methyl (E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoate CAS Name: (E)-3-(2-bromo-4-methylphenyl)-2-propenoic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl (E)-3-(2-bromo-4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(2-bromo-4-methyl-phenyl)acrylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C15H17BrN4O2 MolecularWeight: 365.22508

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C=CC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)/C=C/C2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C15H17BrN4O2/c1-3-8-20-14(17-18-19-20)10-22-15(21)7-6-12-5-4-11(2)9-13(12)16/h4-7,9H,3,8,10H2,1-2H3/b7-6+