[4-[(E)-2-pyridin-4-ylethenyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-2-pyridin-4-ylethenyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-2-(4-pyridyl)vinyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-4-ylethenyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C24H23NO3 MolecularWeight: 373.44432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=CC3=CC=NC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C/C3=CC=NC=C3

InChI

InChI=1S/C24H23NO3/c1-2-3-18-27-22-12-8-21(9-13-22)24(26)28-23-10-6-19(7-11-23)4-5-20-14-16-25-17-15-20/h4-17H,2-3,18H2,1H3/b5-4+