(2R)-2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide

Systemtic Name: (2R)-2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide Openeye Name: (2R)-2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide CAS Name: (2R)-2-[4-(2-phenoxyethyl)-1-piperazin-1-iumyl]-N-(2-phenylphenyl)propanamide IUPAC Name: (2R)-2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide Traditional Name: (2R)-2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propionamide Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-22(27(31)28-26-15-9-8-14-25(26)23-10-4-2-5-11-23)30-18-16-29(17-19-30)20-21-32-24-12-6-3-7-13-24/h2-15,22H,16-21H2,1H3,(H,28,31)/p+1/t22-/m1/s1