(2R)-2-(4-ethylpiperazine-1,4-diium-1-yl)-N-(4-phenoxyphenyl)propanamide

Systemtic Name: (2R)-2-(4-ethylpiperazine-1,4-diium-1-yl)-N-(4-phenoxyphenyl)propanamide Openeye Name: (2R)-2-(4-ethylpiperazine-1,4-diium-1-yl)-N-(4-phenoxyphenyl)propanamide CAS Name: (2R)-2-(4-ethyl-1-piperazine-1,4-diiumyl)-N-(4-phenoxyphenyl)propanamide IUPAC Name: (2R)-2-(4-ethylpiperazine-1,4-diium-1-yl)-N-(4-phenoxyphenyl)propanamide Traditional Name: (2R)-2-(4-ethylpiperazine-1,4-diium-1-yl)-N-(4-phenoxyphenyl)propionamide Formula: C21H29N3O2+2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)C(C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)[C@H](C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-3-23-13-15-24(16-14-23)17(2)21(25)22-18-9-11-20(12-10-18)26-19-7-5-4-6-8-19/h4-12,17H,3,13-16H2,1-2H3,(H,22,25)/p+2/t17-/m1/s1