3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-6-phenoxy-1H-quinolin-4-one

Systemtic Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-6-phenoxy-1H-quinolin-4-one Openeye Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-6-phenoxy-1H-quinolin-4-one CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-2-methyl-6-phenoxy-1H-quinolin-4-one IUPAC Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-6-phenoxy-1H-quinolin-4-one Traditional Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-6-phenoxy-4-quinolone Formula: C23H28N3O2+ MolecularWeight: 378.48732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(NC3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(NC3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3O2/c1-3-25-11-13-26(14-12-25)16-21-17(2)24-22-10-9-19(15-20(22)23(21)27)28-18-7-5-4-6-8-18/h4-10,15H,3,11-14,16H2,1-2H3,(H,24,27)/p+1