methyl 5-azanyl-6-chloranyl-3-[1-(3-ethoxy-3-oxidanylidene-propyl)piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate

Systemtic Name: methyl 5-azanyl-6-chloranyl-3-[1-(3-ethoxy-3-oxidanylidene-propyl)piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate Openeye Name: methyl 5-amino-6-chloro-3-[1-(3-ethoxy-3-oxo-propyl)-4-piperidyl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate CAS Name: 5-amino-6-chloro-3-[1-(3-ethoxy-3-oxopropyl)-4-piperidinyl]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid methyl ester IUPAC Name: methyl 5-amino-6-chloro-3-[1-(3-ethoxy-3-oxopropyl)piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate Traditional Name: 5-amino-6-chloro-3-[1-(3-ethoxy-3-keto-propyl)-4-piperidyl]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid methyl ester Formula: C20H27ClN2O6 MolecularWeight: 426.89118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CCC(CC1)C2COC3=C(O2)C(=C(C=C3C(=O)OC)Cl)N

Isomeric SMILES

CCOC(=O)CCN1CCC(CC1)C2COC3=C(O2)C(=C(C=C3C(=O)OC)Cl)N

InChI

InChI=1S/C20H27ClN2O6/c1-3-27-16(24)6-9-23-7-4-12(5-8-23)15-11-28-18-13(20(25)26-2)10-14(21)17(22)19(18)29-15/h10,12,15H,3-9,11,22H2,1-2H3