[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate Openeye Name: [2-(dimethylamino)-2-oxo-1-phenyl-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-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxo-1-phenylethyl] (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 [2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O3/c1-12-14(17(19)22(4)20-12)10-11-15(23)25-16(18(24)21(2)3)13-8-6-5-7-9-13/h5-11,16H,1-4H3/b11-10+