2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(1R)-1-phenylethyl]ethanamide

Systemtic Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(1R)-1-phenylethyl]ethanamide Openeye Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(1R)-1-phenylethyl]acetamide CAS Name: 2-[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]-N-methyl-N-[(1R)-1-phenylethyl]acetamide IUPAC Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(1R)-1-phenylethyl]acetamide Traditional Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]-N-methyl-N-[(1R)-1-phenylethyl]acetamide Formula: C23H32N3O+ MolecularWeight: 366.51968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC(=O)N(C)C(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC(=O)N(C)[C@H](C)C3=CC=CC=C3)C

InChI

InChI=1S/C23H31N3O/c1-18-9-8-12-22(19(18)2)26-15-13-25(14-16-26)17-23(27)24(4)20(3)21-10-6-5-7-11-21/h5-12,20H,13-17H2,1-4H3/p+1/t20-/m1/s1