1H-imidazol-5-yl (E)-3-(3-aminocarbonyl-4-dodecyl-phenyl)prop-2-enoate

Systemtic Name: 1H-imidazol-5-yl (E)-3-(3-aminocarbonyl-4-dodecyl-phenyl)prop-2-enoate Openeye Name: 1H-imidazol-5-yl (E)-3-(3-carbamoyl-4-dodecyl-phenyl)prop-2-enoate CAS Name: (E)-3-(3-carbamoyl-4-dodecylphenyl)-2-propenoic acid 1H-imidazol-5-yl ester IUPAC Name: 1H-imidazol-5-yl (E)-3-(3-carbamoyl-4-dodecylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-carbamoyl-4-lauryl-phenyl)acrylic acid 1H-imidazol-5-yl ester Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C=C(C=C1)C=CC(=O)OC2=CN=CN2)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCC1=C(C=C(C=C1)/C=C/C(=O)OC2=CN=CN2)C(=O)N

InChI

InChI=1S/C25H35N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-21-15-13-20(17-22(21)25(26)30)14-16-24(29)31-23-18-27-19-28-23/h13-19H,2-12H2,1H3,(H2,26,30)(H,27,28)/b16-14+