methyl N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]carbamate

Systemtic Name: methyl N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]carbamate Openeye Name: methyl N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]carbamate CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]carbamate Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]carbamic acid methyl ester Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)OC)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H30N4O2/c1-24(2)19-11-9-18(10-12-19)21(17-23-22(27)28-3)26-15-13-25(14-16-26)20-7-5-4-6-8-20/h4-12,21H,13-17H2,1-3H3,(H,23,27)/p+1/t21-/m0/s1