(2S)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethyl-2-phenyl-ethanamide Openeye Name: (2S)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethyl-2-phenyl-acetamide CAS Name: (2S)-2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N,N-dimethyl-2-phenylacetamide IUPAC Name: (2S)-2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethyl-2-phenylacetamide Traditional Name: (2S)-2-[4-(2-methoxy-5-methyl-benzyl)piperazine-1,4-diium-1-yl]-N,N-dimethyl-2-phenyl-acetamide Formula: C23H33N3O2+2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)[C@@H](C3=CC=CC=C3)C(=O)N(C)C

InChI

InChI=1S/C23H31N3O2/c1-18-10-11-21(28-4)20(16-18)17-25-12-14-26(15-13-25)22(23(27)24(2)3)19-8-6-5-7-9-19/h5-11,16,22H,12-15,17H2,1-4H3/p+2/t22-/m0/s1