[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]-(2,4,6-trimethylphenyl)methanone

Systemtic Name: [4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]-(2,4,6-trimethylphenyl)methanone Openeye Name: [4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-(2,4,6-trimethylphenyl)methanone CAS Name: [4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]-(2,4,6-trimethylphenyl)methanone IUPAC Name: [4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]-(2,4,6-trimethylphenyl)methanone Traditional Name: mesityl-[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methanone Formula: C22H27N2O2+ MolecularWeight: 351.46198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C22H26N2O2/c1-15-13-16(2)20(17(3)14-15)21(25)18-5-7-19(8-6-18)22(26)24-11-9-23(4)10-12-24/h5-8,13-14H,9-12H2,1-4H3/p+1