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

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate CAS Name: 3-(1,3-diphenyl-4-pyrazolyl)-2-propenoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Traditional Name: 3-(1,3-diphenylpyrazol-4-yl)acrylic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)OCC(=O)NCC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)OCC(=O)NCC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O4/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/h1-15,17H,16,18H2,(H,26,29)