4-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-4-ium-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-4-ium-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-[2-(4-chlorophenoxy)ethyl]piperazin-4-ium-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-4-iumyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 4-[4-[2-(4-chlorophenoxy)ethyl]piperazin-4-ium-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-[4-[2-(4-chlorophenoxy)ethyl]piperazin-4-ium-1-carbonyl]carbostyril Formula: C22H23ClN3O3+ MolecularWeight: 412.88932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)Cl)C(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=C(C=C2)Cl)C(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C22H22ClN3O3/c23-16-5-7-17(8-6-16)29-14-13-25-9-11-26(12-10-25)22(28)19-15-21(27)24-20-4-2-1-3-18(19)20/h1-8,15H,9-14H2,(H,24,27)/p+1