(E)-1-(5,6-diphenyl-3-piperidin-1-yl-pyridazin-4-yl)-3-(4-methoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5,6-diphenyl-3-piperidin-1-yl-pyridazin-4-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[5,6-diphenyl-3-(1-piperidyl)pyridazin-4-yl]-3-(4-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[5,6-diphenyl-3-(1-piperidinyl)-4-pyridazinyl]-3-(4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(5,6-diphenyl-3-piperidin-1-ylpyridazin-4-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(5,6-diphenyl-3-piperidino-pyridazin-4-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Formula: C31H29N3O2 MolecularWeight: 475.58086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)C2=C(C(=NN=C2N3CCCCC3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)C2=C(C(=NN=C2N3CCCCC3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H29N3O2/c1-36-26-18-15-23(16-19-26)17-20-27(35)29-28(24-11-5-2-6-12-24)30(25-13-7-3-8-14-25)32-33-31(29)34-21-9-4-10-22-34/h2-3,5-8,11-20H,4,9-10,21-22H2,1H3/b20-17+