N-[2-[(2S)-butan-2-yl]phenyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-[(2S)-butan-2-yl]phenyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[2-[(1S)-1-methylpropyl]phenyl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-[(2S)-butan-2-yl]phenyl]-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-[(2S)-butan-2-yl]phenyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[2-[(1S)-1-methylpropyl]phenyl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C23H32N3O+ MolecularWeight: 366.51968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C23H31N3O/c1-4-18(2)20-10-6-7-11-21(20)24-23(27)17-25-13-15-26(16-14-25)22-12-8-5-9-19(22)3/h5-12,18H,4,13-17H2,1-3H3,(H,24,27)/p+1/t18-/m0/s1