(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) (E)-3-[5-chloranyl-1-[(3-methoxyphenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) (E)-3-[5-chloranyl-1-[(3-methoxyphenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) (E)-3-[5-chloro-1-[(3-methoxyphenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[5-chloro-1-[(3-methoxyphenyl)methyl]-3-methyl-4-pyrazolyl]-2-propenoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) (E)-3-[5-chloro-1-[(3-methoxyphenyl)methyl]-3-methylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-(5-chloro-1-m-anisyl-3-methyl-pyrazol-4-yl)acrylic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCC(=O)N2CCCC2)Cl)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OCC(=O)N2CCCC2)Cl)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H24ClN3O4/c1-15-18(8-9-20(27)29-14-19(26)24-10-3-4-11-24)21(22)25(23-15)13-16-6-5-7-17(12-16)28-2/h5-9,12H,3-4,10-11,13-14H2,1-2H3/b9-8+