ethyl 5-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[(E)-3-(3,4-dichlorophenyl)-1-oxoprop-2-enyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[[(E)-3-(3,4-dichlorophenyl)acryloyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H17Cl2N3O3 MolecularWeight: 430.28398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C=CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)/C=C/C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H17Cl2N3O3/c1-2-29-21(28)16-13-24-26(15-6-4-3-5-7-15)20(16)25-19(27)11-9-14-8-10-17(22)18(23)12-14/h3-13H,2H2,1H3,(H,25,27)/b11-9+