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

Systemtic Name: (2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoate Openeye Name: (2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl) (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-propenoic acid [2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl) (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acrylic acid (2-keto-1-phenyl-2-pyrrolidino-ethyl) ester Formula: C26H27N3O3 MolecularWeight: 429.51088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)OC(C3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)OC(C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C26H27N3O3/c1-19-23(20(2)29(27-19)22-13-7-4-8-14-22)15-16-24(30)32-25(21-11-5-3-6-12-21)26(31)28-17-9-10-18-28/h3-8,11-16,25H,9-10,17-18H2,1-2H3/b16-15+