N-[(1R)-3-oxidanylidene-1-phenyl-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]propyl]ethanamide

Systemtic Name: N-[(1R)-3-oxidanylidene-1-phenyl-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]propyl]ethanamide Openeye Name: N-[(1R)-3-[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-1-phenyl-propyl]acetamide CAS Name: N-[(1R)-3-oxo-1-phenyl-3-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]propyl]acetamide IUPAC Name: N-[(1R)-3-oxo-1-phenyl-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]propyl]acetamide Traditional Name: N-[(1R)-3-[4-(4-isopropylbenzyl)piperazin-4-ium-1-yl]-3-keto-1-phenyl-propyl]acetamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O2/c1-19(2)22-11-9-21(10-12-22)18-27-13-15-28(16-14-27)25(30)17-24(26-20(3)29)23-7-5-4-6-8-23/h4-12,19,24H,13-18H2,1-3H3,(H,26,29)/p+1/t24-/m1/s1