N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(1S)-1-(4-isobutylphenyl)ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(1S)-1-(4-isobutylphenyl)ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

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