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

Systemtic Name: 5-azanyl-6-chloranyl-8-[[1-(2-methylbutyl)piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate hydrochloride Openeye Name: 5-amino-6-chloro-8-[[1-(2-methylbutyl)-4-piperidyl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate hydrochloride CAS Name: 5-amino-6-chloro-8-[[1-(2-methylbutyl)-4-piperidinyl]methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxylate hydrochloride IUPAC Name: 5-amino-6-chloro-8-[[1-(2-methylbutyl)piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylate hydrochloride Traditional Name: 5-amino-6-chloro-8-[[1-(2-methylbutyl)-4-piperidyl]methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxylate hydrochloride Formula: C20H29Cl2N2O4- MolecularWeight: 432.36126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1CCC(CC1)CC2=CC(=C(C3=C2OCC(O3)C(=O)[O-])N)Cl.Cl

Isomeric SMILES

CCC(C)CN1CCC(CC1)CC2=CC(=C(C3=C2OCC(O3)C(=O)[O-])N)Cl.Cl

InChI

InChI=1S/C20H29ClN2O4.ClH/c1-3-12(2)10-23-6-4-13(5-7-23)8-14-9-15(21)17(22)19-18(14)26-11-16(27-19)20(24)25;/h9,12-13,16H,3-8,10-11,22H2,1-2H3,(H,24,25);1H/p-1