6-chloranyl-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-phenyl-1H-quinolin-4-one

Systemtic Name: 6-chloranyl-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-phenyl-1H-quinolin-4-one Openeye Name: 6-chloro-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-phenyl-1H-quinolin-4-one CAS Name: 6-chloro-3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-2-phenyl-1H-quinolin-4-one IUPAC Name: 6-chloro-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-phenyl-1H-quinolin-4-one Traditional Name: 6-chloro-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-phenyl-4-quinolone Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(NC3=C(C2=O)C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(NC3=C(C2=O)C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H24ClN3O/c1-2-25-10-12-26(13-11-25)15-19-21(16-6-4-3-5-7-16)24-20-9-8-17(23)14-18(20)22(19)27/h3-9,14H,2,10-13,15H2,1H3,(H,24,27)/p+1