ethyl (Z)-3-(2-chlorophenyl)-2-[4-(3,5-dimethyl-1,2,4-triazol-1-yl)phenyl]carbonyl-prop-2-enoate

Systemtic Name: ethyl (Z)-3-(2-chlorophenyl)-2-[4-(3,5-dimethyl-1,2,4-triazol-1-yl)phenyl]carbonyl-prop-2-enoate Openeye Name: ethyl (Z)-3-(2-chlorophenyl)-2-[4-(3,5-dimethyl-1,2,4-triazol-1-yl)benzoyl]prop-2-enoate CAS Name: (Z)-3-(2-chlorophenyl)-2-[[4-(3,5-dimethyl-1,2,4-triazol-1-yl)phenyl]-oxomethyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-(2-chlorophenyl)-2-[4-(3,5-dimethyl-1,2,4-triazol-1-yl)benzoyl]prop-2-enoate Traditional Name: (Z)-3-(2-chlorophenyl)-2-[4-(3,5-dimethyl-1,2,4-triazol-1-yl)benzoyl]acrylic acid ethyl ester Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CC=C1Cl)C(=O)C2=CC=C(C=C2)N3C(=NC(=N3)C)C

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC=CC=C1Cl)/C(=O)C2=CC=C(C=C2)N3C(=NC(=N3)C)C

InChI

InChI=1S/C22H20ClN3O3/c1-4-29-22(28)19(13-17-7-5-6-8-20(17)23)21(27)16-9-11-18(12-10-16)26-15(3)24-14(2)25-26/h5-13H,4H2,1-3H3/b19-13-