ethyl 4-(cyclopropylmethyl)-1-[(5-ethylfuran-2-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-(cyclopropylmethyl)-1-[(5-ethylfuran-2-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-(cyclopropylmethyl)-1-[(5-ethyl-2-furyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 4-(cyclopropylmethyl)-1-[(5-ethyl-2-furanyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclopropylmethyl)-1-[(5-ethylfuran-2-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 4-(cyclopropylmethyl)-1-[(5-ethyl-2-furyl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H30NO3+ MolecularWeight: 320.4464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C[NH+]2CCC(CC2)(CC3CC3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(O1)C[NH+]2CCC(CC2)(CC3CC3)C(=O)OCC

InChI

InChI=1S/C19H29NO3/c1-3-16-7-8-17(23-16)14-20-11-9-19(10-12-20,13-15-5-6-15)18(21)22-4-2/h7-8,15H,3-6,9-14H2,1-2H3/p+1