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

Systemtic Name: 6-ethyl-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one Openeye Name: 6-ethyl-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one CAS Name: 6-ethyl-3-(1-piperazin-4-iumylmethyl)-1H-quinolin-2-one IUPAC Name: 6-ethyl-3-(piperazin-4-ium-1-ylmethyl)-1H-quinolin-2-one Traditional Name: 6-ethyl-3-(piperazin-4-ium-1-ylmethyl)carbostyril Formula: C16H22N3O+ MolecularWeight: 272.36538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN3CC[NH2+]CC3

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN3CC[NH2+]CC3

InChI

InChI=1S/C16H21N3O/c1-2-12-3-4-15-13(9-12)10-14(16(20)18-15)11-19-7-5-17-6-8-19/h3-4,9-10,17H,2,5-8,11H2,1H3,(H,18,20)/p+1