[4-(methylcarbamoyl)phenyl] (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: [4-(methylcarbamoyl)phenyl] (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enoate Openeye Name: [4-(methylcarbamoyl)phenyl] (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-2-propenoic acid [4-(methylcarbamoyl)phenyl] ester IUPAC Name: [4-(methylcarbamoyl)phenyl] (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)acrylic acid [4-(methylcarbamoyl)phenyl] ester Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)OC2=CC=C(C=C2)C(=O)NC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)OC2=CC=C(C=C2)C(=O)NC)Cl

InChI

InChI=1S/C19H22ClN3O3/c1-4-5-12-23-18(20)16(13(2)22-23)10-11-17(24)26-15-8-6-14(7-9-15)19(25)21-3/h6-11H,4-5,12H2,1-3H3,(H,21,25)/b11-10+