tert-butyl 4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H25BrN2O5 MolecularWeight: 441.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C19H25BrN2O5/c1-19(2,3)27-18(24)22-6-4-12(5-7-22)17(23)21-14-11-16-15(10-13(14)20)25-8-9-26-16/h10-12H,4-9H2,1-3H3,(H,21,23)