(6-methyl-2-phenyl-quinolin-4-yl)-(4-prop-2-ynylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (6-methyl-2-phenyl-quinolin-4-yl)-(4-prop-2-ynylpiperazin-4-ium-1-yl)methanone Openeye Name: (6-methyl-2-phenyl-4-quinolyl)-(4-prop-2-ynylpiperazin-4-ium-1-yl)methanone CAS Name: (6-methyl-2-phenyl-4-quinolinyl)-(4-prop-2-ynyl-1-piperazin-4-iumyl)methanone IUPAC Name: (6-methyl-2-phenylquinolin-4-yl)-(4-prop-2-ynylpiperazin-4-ium-1-yl)methanone Traditional Name: (6-methyl-2-phenyl-4-quinolyl)-(4-propargylpiperazin-4-ium-1-yl)methanone Formula: C24H24N3O+ MolecularWeight: 370.46686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CC[NH+](CC3)CC#C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CC[NH+](CC3)CC#C)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O/c1-3-11-26-12-14-27(15-13-26)24(28)21-17-23(19-7-5-4-6-8-19)25-22-10-9-18(2)16-20(21)22/h1,4-10,16-17H,11-15H2,2H3/p+1