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

Systemtic Name: methyl 5-azanyl-6-chloranyl-3-[1-[3-(2-methyl-1,3-dioxolan-2-yl)propyl]-3-oxidanyl-piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate Openeye Name: methyl 5-amino-6-chloro-3-[3-hydroxy-1-[3-(2-methyl-1,3-dioxolan-2-yl)propyl]-4-piperidyl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate CAS Name: 5-amino-6-chloro-3-[3-hydroxy-1-[3-(2-methyl-1,3-dioxolan-2-yl)propyl]-4-piperidinyl]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid methyl ester IUPAC Name: methyl 5-amino-6-chloro-3-[3-hydroxy-1-[3-(2-methyl-1,3-dioxolan-2-yl)propyl]piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxylate Traditional Name: 5-amino-6-chloro-3-[3-hydroxy-1-[3-(2-methyl-1,3-dioxolan-2-yl)propyl]-4-piperidyl]-2,3-dihydro-1,4-benzodioxin-8-carboxylic acid methyl ester Formula: C22H31ClN2O7 MolecularWeight: 470.94374

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCCN2CCC(C(C2)O)C3COC4=C(O3)C(=C(C=C4C(=O)OC)Cl)N

Isomeric SMILES

CC1(OCCO1)CCCN2CCC(C(C2)O)C3COC4=C(O3)C(=C(C=C4C(=O)OC)Cl)N

InChI

InChI=1S/C22H31ClN2O7/c1-22(30-8-9-31-22)5-3-6-25-7-4-13(16(26)11-25)17-12-29-19-14(21(27)28-2)10-15(23)18(24)20(19)32-17/h10,13,16-17,26H,3-9,11-12,24H2,1-2H3