[2-[(E)-2-(1-methyl-9bH-perimidin-1-ium-2-yl)ethenyl]phenyl] ethanoate

Systemtic Name: [2-[(E)-2-(1-methyl-9bH-perimidin-1-ium-2-yl)ethenyl]phenyl] ethanoate Openeye Name: [2-[(E)-2-(1-methyl-9bH-perimidin-1-ium-2-yl)vinyl]phenyl] acetate CAS Name: acetic acid [2-[(E)-2-(1-methyl-9bH-perimidin-1-ium-2-yl)ethenyl]phenyl] ester IUPAC Name: [2-[(E)-2-(1-methyl-9bH-perimidin-1-ium-2-yl)ethenyl]phenyl] acetate Traditional Name: acetic acid [2-[(E)-2-(1-methyl-9bH-perimidin-1-ium-2-yl)vinyl]phenyl] ester Formula: C22H19N2O2+ MolecularWeight: 343.39846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C=CC2=NC3=CC=CC4=CC=CC(=[N+]2C)C43

Isomeric SMILES

CC(=O)OC1=CC=CC=C1/C=C/C2=NC3=CC=CC4=CC=CC(=[N+]2C)C43

InChI

InChI=1S/C22H19N2O2/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/h3-14,22H,1-2H3/q+1/b14-13+