1-[(4-methylphenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1,8-naphthyridin-2-one

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1,8-naphthyridin-2-one Openeye Name: 3-(4-methylpiperazin-4-ium-1-carbonyl)-1-(p-tolylmethyl)-1,8-naphthyridin-2-one CAS Name: 1-[(4-methylphenyl)methyl]-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1,8-naphthyridin-2-one IUPAC Name: 1-[(4-methylphenyl)methyl]-3-(4-methylpiperazin-4-ium-1-carbonyl)-1,8-naphthyridin-2-one Traditional Name: 1-(4-methylbenzyl)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1,8-naphthyridin-2-one Formula: C22H25N4O2+ MolecularWeight: 377.4595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C=CC=N3)C=C(C2=O)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C=CC=N3)C=C(C2=O)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C22H24N4O2/c1-16-5-7-17(8-6-16)15-26-20-18(4-3-9-23-20)14-19(22(26)28)21(27)25-12-10-24(2)11-13-25/h3-9,14H,10-13,15H2,1-2H3/p+1