N-(2,6-dimethylphenyl)-2-[4-(3-methoxy-4-methyl-phenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(3-methoxy-4-methyl-phenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(3-methoxy-4-methyl-benzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(3-methoxy-4-methylphenyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(3-methoxy-4-methylbenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(3-methoxy-4-methyl-benzoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)OC

InChI

InChI=1S/C23H29N3O3/c1-16-8-9-19(14-20(16)29-4)23(28)26-12-10-25(11-13-26)15-21(27)24-22-17(2)6-5-7-18(22)3/h5-9,14H,10-13,15H2,1-4H3,(H,24,27)/p+1