tert-butyl 4-[6-[4-(3-oxidanylpropylcarbamoyl)phenyl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[4-(3-oxidanylpropylcarbamoyl)phenyl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[6-[4-(3-hydroxypropylcarbamoyl)phenyl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate CAS Name: 4-[6-[4-[(3-hydroxypropylamino)-oxomethyl]phenyl]-4H-1,3-benzodioxin-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[4-(3-hydroxypropylcarbamoyl)phenyl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylate Traditional Name: 4-[6-[4-(3-hydroxypropylcarbamoyl)phenyl]-4H-1,3-benzodioxin-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H36N2O6 MolecularWeight: 496.59524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O6/c1-28(2,3)36-27(33)30-14-11-21(12-15-30)26-34-18-23-17-22(9-10-24(23)35-26)19-5-7-20(8-6-19)25(32)29-13-4-16-31/h5-10,17,21,26,31H,4,11-16,18H2,1-3H3,(H,29,32)