3-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-N-[(1S)-1-phenylethyl]propanamide

Systemtic Name: 3-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-N-[(1S)-1-phenylethyl]propanamide Openeye Name: 3-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-N-[(1S)-1-phenylethyl]propanamide CAS Name: 3-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]-N-[(1S)-1-phenylethyl]propanamide IUPAC Name: 3-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-N-[(1S)-1-phenylethyl]propanamide Traditional Name: 3-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]-N-[(1S)-1-phenylethyl]propionamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCN2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CCN2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2/c1-20(21-8-4-2-5-9-21)24-23(27)12-13-25-14-16-26(17-15-25)18-19-28-22-10-6-3-7-11-22/h2-11,20H,12-19H2,1H3,(H,24,27)/p+1/t20-/m0/s1