(2R)-N-(3,4-dimethoxyphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(3,4-dimethoxyphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-(3,4-dimethoxyphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(3,4-dimethoxyphenyl)-2-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-(3,4-dimethoxyphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(3,4-dimethoxyphenyl)-2-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3/c1-16(21(25)22-17-9-10-19(26-2)20(15-17)27-3)23-11-13-24(14-12-23)18-7-5-4-6-8-18/h4-10,15-16H,11-14H2,1-3H3,(H,22,25)/p+1/t16-/m1/s1