[2-[(E)-2-(1-methylperimidin-2-yl)ethenyl]phenyl] ethanoate

Systemtic Name: [2-[(E)-2-(1-methylperimidin-2-yl)ethenyl]phenyl] ethanoate Openeye Name: [2-[(E)-2-(1-methylperimidin-2-yl)vinyl]phenyl] acetate CAS Name: acetic acid [2-[(E)-2-(1-methyl-2-perimidinyl)ethenyl]phenyl] ester IUPAC Name: [2-[(E)-2-(1-methylperimidin-2-yl)ethenyl]phenyl] acetate Traditional Name: acetic acid [2-[(E)-2-(1-methylperimidin-2-yl)vinyl]phenyl] ester Formula: C22H18N2O2 MolecularWeight: 342.39052

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C=CC2=NC3=CC=CC4=C3C(=CC=C4)N2C

Isomeric SMILES

CC(=O)OC1=CC=CC=C1/C=C/C2=NC3=CC=CC4=C3C(=CC=C4)N2C

InChI

InChI=1S/C22H18N2O2/c1-15(25)26-20-12-4-3-7-16(20)13-14-21-23-18-10-5-8-17-9-6-11-19(22(17)18)24(21)2/h3-14H,1-2H3/b14-13+