2,2-bis(chloranyl)-N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]ethanamide

Systemtic Name: 2,2-bis(chloranyl)-N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]ethanamide Openeye Name: 2,2-dichloro-N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]acetamide CAS Name: 2,2-dichloro-N-[2-[(3-cyano-7-methyl-2-quinolin-1-iumyl)amino]ethyl]acetamide IUPAC Name: 2,2-dichloro-N-[2-[(3-cyano-7-methylquinolin-1-ium-2-yl)amino]ethyl]acetamide Traditional Name: 2,2-dichloro-N-[2-[(3-cyano-7-methyl-quinolin-1-ium-2-yl)amino]ethyl]acetamide Formula: C15H15Cl2N4O+ MolecularWeight: 338.2118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=[NH+]2)NCCNC(=O)C(Cl)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=[NH+]2)NCCNC(=O)C(Cl)Cl)C#N

InChI

InChI=1S/C15H14Cl2N4O/c1-9-2-3-10-7-11(8-18)14(21-12(10)6-9)19-4-5-20-15(22)13(16)17/h2-3,6-7,13H,4-5H2,1H3,(H,19,21)(H,20,22)/p+1