(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide

Systemtic Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide Openeye Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide CAS Name: (2R)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-N-(4-phenoxyphenyl)propanamide IUPAC Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-phenoxyphenyl)propanamide Traditional Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(4-phenoxyphenyl)propionamide Formula: C26H30N3O3+ MolecularWeight: 432.5347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C26H29N3O3/c1-20(28-16-18-29(19-17-28)24-10-6-7-11-25(24)31-2)26(30)27-21-12-14-23(15-13-21)32-22-8-4-3-5-9-22/h3-15,20H,16-19H2,1-2H3,(H,27,30)/p+1/t20-/m1/s1