[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] (E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] (E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Openeye Name: [2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl] (E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3-diphenyl-4-pyrazolyl)-2-propenoic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(oxolan-2-ylmethylamino)ethyl] (E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-diphenylpyrazol-4-yl)acrylic acid [2-keto-2-(tetrahydrofurfurylamino)ethyl] ester Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)COC(=O)C=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)COC(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4/c29-23(26-16-22-12-7-15-31-22)18-32-24(30)14-13-20-17-28(21-10-5-2-6-11-21)27-25(20)19-8-3-1-4-9-19/h1-6,8-11,13-14,17,22H,7,12,15-16,18H2,(H,26,29)/b14-13+