(2-oxidanylidene-1,2-diphenyl-ethyl) (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-2-propenoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) (E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acrylic acid desyl ester Formula: C22H19ClN2O3 MolecularWeight: 394.85086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)Cl)C

InChI

InChI=1S/C22H19ClN2O3/c1-15-18(22(23)25(2)24-15)13-14-19(26)28-21(17-11-7-4-8-12-17)20(27)16-9-5-3-6-10-16/h3-14,21H,1-2H3/b14-13+