(E)-4-quinolin-1-ium-2-ylbut-3-en-2-one chloride

Systemtic Name: (E)-4-quinolin-1-ium-2-ylbut-3-en-2-one chloride Openeye Name: (E)-4-quinolin-1-ium-2-ylbut-3-en-2-one chloride CAS Name: (E)-4-(2-quinolin-1-iumyl)-3-buten-2-one chloride IUPAC Name: (E)-4-quinolin-1-ium-2-ylbut-3-en-2-one chloride Traditional Name: (E)-4-quinolin-1-ium-2-ylbut-3-en-2-one chloride Formula: C13H12ClNO MolecularWeight: 233.69348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=[NH+]C2=CC=CC=C2C=C1.[Cl-]

Isomeric SMILES

CC(=O)/C=C/C1=[NH+]C2=CC=CC=C2C=C1.[Cl-]

InChI

InChI=1S/C13H11NO.ClH/c1-10(15)6-8-12-9-7-11-4-2-3-5-13(11)14-12;/h2-9H,1H3;1H/b8-6+;