methyl 5-azanyl-6-chloranyl-3-[1-[2-(2-hydroxyethyloxy)ethyl]-3-oxidanyl-piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate

Systemtic Name: methyl 5-azanyl-6-chloranyl-3-[1-[2-(2-hydroxyethyloxy)ethyl]-3-oxidanyl-piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate Openeye Name: methyl 5-amino-6-chloro-3-[3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-4-piperidyl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate CAS Name: 5-amino-6-chloro-3-[3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-4-piperidinyl]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid methyl ester IUPAC Name: methyl 5-amino-6-chloro-3-[3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate Traditional Name: 5-amino-6-chloro-3-[3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-4-piperidyl]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid methyl ester Formula: C19H27ClN2O7 MolecularWeight: 430.87988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C2=C1OCC(O2)C3CCN(CC3O)CCOCCO)N)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C2=C1OCC(O2)C3CCN(CC3O)CCOCCO)N)Cl

InChI

InChI=1S/C19H27ClN2O7/c1-26-19(25)12-8-13(20)16(21)18-17(12)28-10-15(29-18)11-2-3-22(9-14(11)24)4-6-27-7-5-23/h8,11,14-15,23-24H,2-7,9-10,21H2,1H3