ethyl 1-(1,2-oxazol-3-ylmethyl)-4-(2-phenoxyethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-(1,2-oxazol-3-ylmethyl)-4-(2-phenoxyethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-(isoxazol-3-ylmethyl)-4-(2-phenoxyethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-(3-isoxazolylmethyl)-4-(2-phenoxyethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1,2-oxazol-3-ylmethyl)-4-(2-phenoxyethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-(isoxazol-3-ylmethyl)-4-(2-phenoxyethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C20H27N2O4+ MolecularWeight: 359.43938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=NOC=C2)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=NOC=C2)CCOC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O4/c1-2-24-19(23)20(11-15-25-18-6-4-3-5-7-18)9-12-22(13-10-20)16-17-8-14-26-21-17/h3-8,14H,2,9-13,15-16H2,1H3/p+1