[(Z)-1-phenyl-2-(4-phenylphenoxy)-3-pyridin-3-yl-prop-2-enyl] 3-methylbutanoate

Systemtic Name: [(Z)-1-phenyl-2-(4-phenylphenoxy)-3-pyridin-3-yl-prop-2-enyl] 3-methylbutanoate Openeye Name: [(Z)-1-phenyl-2-(4-phenylphenoxy)-3-(3-pyridyl)allyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [(Z)-1-phenyl-2-(4-phenylphenoxy)-3-(3-pyridinyl)prop-2-enyl] ester IUPAC Name: [(Z)-1-phenyl-2-(4-phenylphenoxy)-3-pyridin-3-ylprop-2-enyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [(Z)-1-phenyl-2-(4-phenylphenoxy)-3-(3-pyridyl)allyl] ester Formula: C31H29NO3 MolecularWeight: 463.56686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC(C1=CC=CC=C1)C(=CC2=CN=CC=C2)OC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)OC(C1=CC=CC=C1)/C(=C/C2=CN=CC=C2)/OC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H29NO3/c1-23(2)20-30(33)35-31(27-13-7-4-8-14-27)29(21-24-10-9-19-32-22-24)34-28-17-15-26(16-18-28)25-11-5-3-6-12-25/h3-19,21-23,31H,20H2,1-2H3/b29-21-