N-(4-cyclohexylphenyl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-cyclohexylphenyl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-cyclohexylphenyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-cyclohexylphenyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-cyclohexylphenyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-cyclohexylphenyl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C23H29N3O3/c27-22(24-20-10-8-19(9-11-20)18-5-2-1-3-6-18)17-25-12-14-26(15-13-25)23(28)21-7-4-16-29-21/h4,7-11,16,18H,1-3,5-6,12-15,17H2,(H,24,27)/p+1