4,7-bis(chloromethyl)-1-methyl-4aH-quinolin-1-ium-2-one

Systemtic Name: 4,7-bis(chloromethyl)-1-methyl-4aH-quinolin-1-ium-2-one Openeye Name: 4,7-bis(chloromethyl)-1-methyl-4aH-quinolin-1-ium-2-one CAS Name: 4,7-bis(chloromethyl)-1-methyl-4aH-quinolin-1-ium-2-one IUPAC Name: 4,7-bis(chloromethyl)-1-methyl-4aH-quinolin-1-ium-2-one Traditional Name: 4,7-bis(chloromethyl)-1-methyl-4aH-quinolin-1-ium-2-one Formula: C12H12Cl2NO+ MolecularWeight: 257.13578

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=C(C=CC2C(=CC1=O)CCl)CCl

Isomeric SMILES

C[N+]1=C2C=C(C=CC2C(=CC1=O)CCl)CCl

InChI

InChI=1S/C12H12Cl2NO/c1-15-11-4-8(6-13)2-3-10(11)9(7-14)5-12(15)16/h2-5,10H,6-7H2,1H3/q+1