2-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4,5-bis(4-methoxyphenyl)pyridazin-3-one

Systemtic Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4,5-bis(4-methoxyphenyl)pyridazin-3-one Openeye Name: 2-[(E)-3-(4-chlorophenyl)allyl]-4,5-bis(4-methoxyphenyl)pyridazin-3-one CAS Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4,5-bis(4-methoxyphenyl)-3-pyridazinone IUPAC Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enyl]-4,5-bis(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[(E)-3-(4-chlorophenyl)allyl]-4,5-bis(4-methoxyphenyl)pyridazin-3-one Formula: C27H23ClN2O3 MolecularWeight: 458.93612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC=CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C/C=C/C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H23ClN2O3/c1-32-23-13-7-20(8-14-23)25-18-29-30(17-3-4-19-5-11-22(28)12-6-19)27(31)26(25)21-9-15-24(33-2)16-10-21/h3-16,18H,17H2,1-2H3/b4-3+