2-oxidanylidenepropyl (E)-3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: 2-oxidanylidenepropyl (E)-3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate Openeye Name: acetonyl (E)-3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[1-phenyl-3-(4-phenylphenyl)-4-pyrazolyl]-2-propenoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl (E)-3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[1-phenyl-3-(4-phenylphenyl)pyrazol-4-yl]acrylic acid acetonyl ester Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C=CC1=CN(N=C1C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)COC(=O)/C=C/C1=CN(N=C1C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H22N2O3/c1-20(30)19-32-26(31)17-16-24-18-29(25-10-6-3-7-11-25)28-27(24)23-14-12-22(13-15-23)21-8-4-2-5-9-21/h2-18H,19H2,1H3/b17-16+