4-(furan-3-ylmethyl)-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one

Systemtic Name: 4-(furan-3-ylmethyl)-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one Openeye Name: 4-(3-furylmethyl)-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one CAS Name: 4-(3-furanylmethyl)-1-(4-methoxyphenyl)-6,6-dimethyl-2-piperazin-4-iumone IUPAC Name: 4-(furan-3-ylmethyl)-1-(4-methoxyphenyl)-6,6-dimethylpiperazin-4-ium-2-one Traditional Name: 4-(3-furfuryl)-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one Formula: C18H23N2O3+ MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C[NH+](CC(=O)N1C2=CC=C(C=C2)OC)CC3=COC=C3)C

Isomeric SMILES

CC1(C[NH+](CC(=O)N1C2=CC=C(C=C2)OC)CC3=COC=C3)C

InChI

InChI=1S/C18H22N2O3/c1-18(2)13-19(10-14-8-9-23-12-14)11-17(21)20(18)15-4-6-16(22-3)7-5-15/h4-9,12H,10-11,13H2,1-3H3/p+1