ethyl 1-[(2-oxidanyl-6,7,8,9-tetrahydrodibenzofuran-1-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2-oxidanyl-6,7,8,9-tetrahydrodibenzofuran-1-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(2-hydroxy-6,7,8,9-tetrahydrodibenzofuran-1-yl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2-hydroxy-6,7,8,9-tetrahydrodibenzofuran-1-yl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-hydroxy-6,7,8,9-tetrahydrodibenzofuran-1-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(2-hydroxy-6,7,8,9-tetrahydrodibenzofuran-1-yl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C21H28NO4+ MolecularWeight: 358.45132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=C(C=CC3=C2C4=C(O3)CCCC4)O

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=C(C=CC3=C2C4=C(O3)CCCC4)O

InChI

InChI=1S/C21H27NO4/c1-2-25-21(24)14-9-11-22(12-10-14)13-16-17(23)7-8-19-20(16)15-5-3-4-6-18(15)26-19/h7-8,14,23H,2-6,9-13H2,1H3/p+1