tert-butyl 4-[6-[4-(2-hydroxyethylcarbamoyl)cyclohexa-1,5-dien-1-yl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[4-(2-hydroxyethylcarbamoyl)cyclohexa-1,5-dien-1-yl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[6-[4-(2-hydroxyethylcarbamoyl)cyclohexa-1,5-dien-1-yl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate CAS Name: 4-[6-[4-[(2-hydroxyethylamino)-oxomethyl]-1-cyclohexa-1,5-dienyl]-4H-1,3-benzodioxin-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[4-(2-hydroxyethylcarbamoyl)cyclohexa-1,5-dien-1-yl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate Traditional Name: 4-[6-[4-(2-hydroxyethylcarbamoyl)cyclohexa-1,5-dien-1-yl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H36N2O6 MolecularWeight: 484.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2OCC3=C(O2)C=CC(=C3)C4=CCC(C=C4)C(=O)NCCO

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2OCC3=C(O2)C=CC(=C3)C4=CCC(C=C4)C(=O)NCCO

InChI

InChI=1S/C27H36N2O6/c1-27(2,3)35-26(32)29-13-10-20(11-14-29)25-33-17-22-16-21(8-9-23(22)34-25)18-4-6-19(7-5-18)24(31)28-12-15-30/h4-6,8-9,16,19-20,25,30H,7,10-15,17H2,1-3H3,(H,28,31)