6-chloranyl-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one Openeye Name: 6-chloro-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one CAS Name: 6-chloro-3-(1-piperazin-4-iumylmethyl)-1H-quinolin-2-one IUPAC Name: 6-chloro-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one Traditional Name: 6-chloro-3-(piperazin-4-ium-1-ylmethyl)carbostyril Formula: C14H17ClN3O+ MolecularWeight: 278.75728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=CC3=C(C=CC(=C3)Cl)NC2=O

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=CC3=C(C=CC(=C3)Cl)NC2=O

InChI

InChI=1S/C14H16ClN3O/c15-12-1-2-13-10(8-12)7-11(14(19)17-13)9-18-5-3-16-4-6-18/h1-2,7-8,16H,3-6,9H2,(H,17,19)/p+1