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

Systemtic Name: 1-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-yl]propan-1-one CAS Name: 1-[4-(7-chloro-4-quinolin-1-iumyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(7-chloroquinolin-1-ium-4-yl)piperazino]propan-1-one Formula: C16H19ClN3O+ MolecularWeight: 304.79456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C3C=CC(=CC3=[NH+]C=C2)Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C3C=CC(=CC3=[NH+]C=C2)Cl

InChI

InChI=1S/C16H18ClN3O/c1-2-16(21)20-9-7-19(8-10-20)15-5-6-18-14-11-12(17)3-4-13(14)15/h3-6,11H,2,7-10H2,1H3/p+1