(2S)-2-(4-phenethylpiperazin-1-ium-1-yl)-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: (2S)-2-(4-phenethylpiperazin-1-ium-1-yl)-N-(4-propan-2-ylphenyl)propanamide Openeye Name: (2S)-N-(4-isopropylphenyl)-2-(4-phenethylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-2-(4-phenethyl-1-piperazin-1-iumyl)-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: (2S)-2-(4-phenethylpiperazin-1-ium-1-yl)-N-(4-propan-2-ylphenyl)propanamide Traditional Name: (2S)-N-p-cumenyl-2-(4-phenethylpiperazin-1-ium-1-yl)propionamide Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C(C)[NH+]2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(C)C)[NH+]2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O/c1-19(2)22-9-11-23(12-10-22)25-24(28)20(3)27-17-15-26(16-18-27)14-13-21-7-5-4-6-8-21/h4-12,19-20H,13-18H2,1-3H3,(H,25,28)/p+1/t20-/m0/s1