[4-(cyclobutylmethyl)piperazin-4-ium-1-yl]-isoquinolin-1-yl-methanone

Systemtic Name: [4-(cyclobutylmethyl)piperazin-4-ium-1-yl]-isoquinolin-1-yl-methanone Openeye Name: [4-(cyclobutylmethyl)piperazin-4-ium-1-yl]-(1-isoquinolyl)methanone CAS Name: [4-(cyclobutylmethyl)-1-piperazin-4-iumyl]-(1-isoquinolinyl)methanone IUPAC Name: [4-(cyclobutylmethyl)piperazin-4-ium-1-yl]-isoquinolin-1-ylmethanone Traditional Name: [4-(cyclobutylmethyl)piperazin-4-ium-1-yl]-(1-isoquinolyl)methanone Formula: C19H24N3O+ MolecularWeight: 310.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C[NH+]2CCN(CC2)C(=O)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1CC(C1)C[NH+]2CCN(CC2)C(=O)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C19H23N3O/c23-19(18-17-7-2-1-6-16(17)8-9-20-18)22-12-10-21(11-13-22)14-15-4-3-5-15/h1-2,6-9,15H,3-5,10-14H2/p+1