[5-ethyl-4-(pyrrolidin-1-ium-1-ylmethyl)furan-2-yl]-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [5-ethyl-4-(pyrrolidin-1-ium-1-ylmethyl)furan-2-yl]-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone Openeye Name: [5-ethyl-4-(pyrrolidin-1-ium-1-ylmethyl)-2-furyl]-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone CAS Name: [5-ethyl-4-(1-pyrrolidin-1-iumylmethyl)-2-furanyl]-[4-(4-hydroxyphenyl)-1-piperazinyl]methanone IUPAC Name: [5-ethyl-4-(pyrrolidin-1-ium-1-ylmethyl)furan-2-yl]-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone Traditional Name: [5-ethyl-4-(pyrrolidin-1-ium-1-ylmethyl)-2-furyl]-[4-(4-hydroxyphenyl)piperazino]methanone Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(O1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)O)C[NH+]4CCCC4

Isomeric SMILES

CCC1=C(C=C(O1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)O)C[NH+]4CCCC4

InChI

InChI=1S/C22H29N3O3/c1-2-20-17(16-23-9-3-4-10-23)15-21(28-20)22(27)25-13-11-24(12-14-25)18-5-7-19(26)8-6-18/h5-8,15,26H,2-4,9-14,16H2,1H3/p+1