3-(4-phenethylpiperazin-4-ium-1-yl)-N-[(1S)-1-phenylethyl]propanamide

Systemtic Name: 3-(4-phenethylpiperazin-4-ium-1-yl)-N-[(1S)-1-phenylethyl]propanamide Openeye Name: 3-(4-phenethylpiperazin-4-ium-1-yl)-N-[(1S)-1-phenylethyl]propanamide CAS Name: 3-(4-phenethyl-1-piperazin-4-iumyl)-N-[(1S)-1-phenylethyl]propanamide IUPAC Name: 3-(4-phenethylpiperazin-4-ium-1-yl)-N-[(1S)-1-phenylethyl]propanamide Traditional Name: 3-(4-phenethylpiperazin-4-ium-1-yl)-N-[(1S)-1-phenylethyl]propionamide Formula: C23H32N3O+ MolecularWeight: 366.51968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCN2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CCN2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O/c1-20(22-10-6-3-7-11-22)24-23(27)13-15-26-18-16-25(17-19-26)14-12-21-8-4-2-5-9-21/h2-11,20H,12-19H2,1H3,(H,24,27)/p+1/t20-/m0/s1