ethyl 4-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H30N3O4+ MolecularWeight: 364.4592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CC[NH+](CC2)CC3=CC=C(O3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CC[NH+](CC2)CC3=CC=C(O3)C

InChI

InChI=1S/C19H29N3O4/c1-3-25-19(24)22-12-10-21(11-13-22)18(23)16-6-8-20(9-7-16)14-17-5-4-15(2)26-17/h4-5,16H,3,6-14H2,1-2H3/p+1