2-[1-(2,6-dimethylphenyl)-4-[1-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-(2,6-dimethylphenyl)-4-[1-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[1-(2,6-dimethylphenyl)-4-[1-(4,5-diphenyloxazol-2-yl)ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[1-(2,6-dimethylphenyl)-4-[1-(4,5-diphenyl-2-oxazolyl)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[1-(2,6-dimethylphenyl)-4-[1-(4,5-diphenyl-1,3-oxazol-2-yl)ethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[1-(2,6-dimethylphenyl)-4-[1-(4,5-diphenyloxazol-2-yl)ethyl]piperazin-1-ium-1-yl]acetamide Formula: C31H35N4O2+ MolecularWeight: 495.6352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)[N+]2(CCN(CC2)C(C)C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)CC(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)[N+]2(CCN(CC2)C(C)C3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)CC(=O)N

InChI

InChI=1S/C31H34N4O2/c1-22-11-10-12-23(2)29(22)35(21-27(32)36)19-17-34(18-20-35)24(3)31-33-28(25-13-6-4-7-14-25)30(37-31)26-15-8-5-9-16-26/h4-16,24H,17-21H2,1-3H3,(H-,32,36)/p+1