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

Systemtic Name: 2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(4-phenylphenyl)ethyl]ethanamide Openeye Name: 2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide CAS Name: 2-[4-(2-phenoxyethyl)-1-piperazin-1-iumyl]-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide IUPAC Name: 2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide Traditional Name: 2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(4-phenylphenyl)ethyl]acetamide Formula: C28H34N3O2+ MolecularWeight: 444.58846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C28H33N3O2/c1-23(24-12-14-26(15-13-24)25-8-4-2-5-9-25)29-28(32)22-31-18-16-30(17-19-31)20-21-33-27-10-6-3-7-11-27/h2-15,23H,16-22H2,1H3,(H,29,32)/p+1/t23-/m1/s1