heptyl (E)-3-(1H-imidazol-5-yl)prop-2-enoate

Systemtic Name: heptyl (E)-3-(1H-imidazol-5-yl)prop-2-enoate Openeye Name: heptyl (E)-3-(1H-imidazol-5-yl)prop-2-enoate CAS Name: (E)-3-(1H-imidazol-5-yl)-2-propenoic acid heptyl ester IUPAC Name: heptyl (E)-3-(1H-imidazol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1H-imidazol-5-yl)acrylic acid heptyl ester Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C=CC1=CN=CN1

Isomeric SMILES

CCCCCCCOC(=O)/C=C/C1=CN=CN1

InChI

InChI=1S/C13H20N2O2/c1-2-3-4-5-6-9-17-13(16)8-7-12-10-14-11-15-12/h7-8,10-11H,2-6,9H2,1H3,(H,14,15)/b8-7+