5-azanyl-3-(1-butylpiperidin-4-yl)-6-chloranyl-3-methyl-2H-1,4-benzodioxine-8-carboxylate hydrochloride

Systemtic Name: 5-azanyl-3-(1-butylpiperidin-4-yl)-6-chloranyl-3-methyl-2H-1,4-benzodioxine-8-carboxylate hydrochloride Openeye Name: 5-amino-3-(1-butyl-4-piperidyl)-6-chloro-3-methyl-2H-1,4-benzodioxine-8-carboxylate hydrochloride CAS Name: 5-amino-3-(1-butyl-4-piperidinyl)-6-chloro-3-methyl-2H-1,4-benzodioxin-8-carboxylate hydrochloride IUPAC Name: 5-amino-3-(1-butylpiperidin-4-yl)-6-chloro-3-methyl-2H-1,4-benzodioxine-8-carboxylate hydrochloride Traditional Name: 5-amino-3-(1-butyl-4-piperidyl)-6-chloro-3-methyl-2H-1,4-benzodioxin-8-carboxylate hydrochloride Formula: C19H27Cl2N2O4- MolecularWeight: 418.33468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C2(COC3=C(O2)C(=C(C=C3C(=O)[O-])Cl)N)C.Cl

Isomeric SMILES

CCCCN1CCC(CC1)C2(COC3=C(O2)C(=C(C=C3C(=O)[O-])Cl)N)C.Cl

InChI

InChI=1S/C19H27ClN2O4.ClH/c1-3-4-7-22-8-5-12(6-9-22)19(2)11-25-16-13(18(23)24)10-14(20)15(21)17(16)26-19;/h10,12H,3-9,11,21H2,1-2H3,(H,23,24);1H/p-1