1-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-yl]-3-(4-chlorophenyl)propan-1-one

Systemtic Name: 1-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-yl]-3-(4-chlorophenyl)propan-1-one Openeye Name: 3-(4-chlorophenyl)-1-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-chlorophenyl)-1-[4-(7-chloro-4-quinolin-1-iumyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-chlorophenyl)-1-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4-chlorophenyl)-1-[4-(7-chloroquinolin-1-ium-4-yl)piperazino]propan-1-one Formula: C22H22Cl2N3O+ MolecularWeight: 415.33558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CC(=CC3=[NH+]C=C2)Cl)C(=O)CCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=C3C=CC(=CC3=[NH+]C=C2)Cl)C(=O)CCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21Cl2N3O/c23-17-4-1-16(2-5-17)3-8-22(28)27-13-11-26(12-14-27)21-9-10-25-20-15-18(24)6-7-19(20)21/h1-2,4-7,9-10,15H,3,8,11-14H2/p+1