N-methyl-N-[4-[(E)-2-quinolin-1-ium-4-ylethenyl]phenyl]ethanamide iodide

Systemtic Name: N-methyl-N-[4-[(E)-2-quinolin-1-ium-4-ylethenyl]phenyl]ethanamide iodide Openeye Name: N-methyl-N-[4-[(E)-2-quinolin-1-ium-4-ylvinyl]phenyl]acetamide iodide CAS Name: N-methyl-N-[4-[(E)-2-(4-quinolin-1-iumyl)ethenyl]phenyl]acetamide iodide IUPAC Name: N-methyl-N-[4-[(E)-2-quinolin-1-ium-4-ylethenyl]phenyl]acetamide iodide Traditional Name: N-methyl-N-[4-[(E)-2-quinolin-1-ium-4-ylvinyl]phenyl]acetamide iodide Formula: C20H19IN2O MolecularWeight: 430.28213

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)C=CC2=CC=[NH+]C3=CC=CC=C23.[I-]

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)/C=C/C2=CC=[NH+]C3=CC=CC=C23.[I-]

InChI

InChI=1S/C20H18N2O.HI/c1-15(23)22(2)18-11-8-16(9-12-18)7-10-17-13-14-21-20-6-4-3-5-19(17)20;/h3-14H,1-2H3;1H/b10-7+;