ethyl 1-[(6-methoxy-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(6-methoxy-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(6-methoxy-2-oxo-1,3-benzoxazol-3-yl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(6-methoxy-2-oxo-1,3-benzoxazol-3-yl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-methoxy-2-oxo-1,3-benzoxazol-3-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(2-keto-6-methoxy-1,3-benzoxazol-3-yl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H23N2O5+ MolecularWeight: 335.37492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CN2C3=C(C=C(C=C3)OC)OC2=O

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CN2C3=C(C=C(C=C3)OC)OC2=O

InChI

InChI=1S/C17H22N2O5/c1-3-23-16(20)12-6-8-18(9-7-12)11-19-14-5-4-13(22-2)10-15(14)24-17(19)21/h4-5,10,12H,3,6-9,11H2,1-2H3/p+1