2-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-(7-chloro-4-quinolin-1-iumyl)-1-piperazin-1-iumyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide Formula: C23H27ClN4O+2 MolecularWeight: 410.93968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C3=C4C=CC(=CC4=[NH+]C=C3)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C3=C4C=CC(=CC4=[NH+]C=C3)Cl

InChI

InChI=1S/C23H25ClN4O/c1-16-4-3-5-17(2)23(16)26-22(29)15-27-10-12-28(13-11-27)21-8-9-25-20-14-18(24)6-7-19(20)21/h3-9,14H,10-13,15H2,1-2H3,(H,26,29)/p+2