[5-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]furan-2-yl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [5-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]furan-2-yl]-piperazin-4-ium-1-yl-methanone Openeye Name: [5-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]-2-furyl]-piperazin-4-ium-1-yl-methanone CAS Name: [5-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]methyl]-2-furanyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: [5-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]methyl]furan-2-yl]-piperazin-4-ium-1-ylmethanone Traditional Name: [5-[[(2S,6S)-2,6-dimethylmorpholino]methyl]-2-furyl]-piperazin-4-ium-1-yl-methanone Formula: C16H26N3O3+ MolecularWeight: 308.39594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CC2=CC=C(O2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)CC2=CC=C(O2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C16H25N3O3/c1-12-9-18(10-13(2)21-12)11-14-3-4-15(22-14)16(20)19-7-5-17-6-8-19/h3-4,12-13,17H,5-11H2,1-2H3/p+1/t12-,13-/m0/s1