methyl (Z)-2-benzamido-3-(3-oxidanylidene-2,5-diphenyl-1H-pyrazol-4-yl)prop-2-enoate

Systemtic Name: methyl (Z)-2-benzamido-3-(3-oxidanylidene-2,5-diphenyl-1H-pyrazol-4-yl)prop-2-enoate Openeye Name: methyl (Z)-2-benzamido-3-(3-oxo-2,5-diphenyl-1H-pyrazol-4-yl)prop-2-enoate CAS Name: (Z)-2-benzamido-3-(3-oxo-2,5-diphenyl-1H-pyrazol-4-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-benzamido-3-(3-oxo-2,5-diphenyl-1H-pyrazol-4-yl)prop-2-enoate Traditional Name: (Z)-2-benzamido-3-(5-keto-1,3-diphenyl-3-pyrazolin-4-yl)acrylic acid methyl ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(NN(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)/C(=C/C1=C(NN(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O4/c1-33-26(32)22(27-24(30)19-13-7-3-8-14-19)17-21-23(18-11-5-2-6-12-18)28-29(25(21)31)20-15-9-4-10-16-20/h2-17,28H,1H3,(H,27,30)/b22-17-