tert-butyl 4-[4-(1,3-benzodioxol-5-yl)-3-methyl-phenyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(1,3-benzodioxol-5-yl)-3-methyl-phenyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1,3-benzodioxol-5-yl)-3-methyl-phenyl]-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-[4-(1,3-benzodioxol-5-yl)-3-methylphenyl]-4-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(1,3-benzodioxol-5-yl)-3-methylphenyl]-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-[4-(1,3-benzodioxol-5-yl)-3-methyl-phenyl]-4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C24H29NO5 MolecularWeight: 411.49076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCN(CC2)C(=O)OC(C)(C)C)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCN(CC2)C(=O)OC(C)(C)C)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H29NO5/c1-16-13-18(6-7-19(16)17-5-8-20-21(14-17)29-15-28-20)24(27)9-11-25(12-10-24)22(26)30-23(2,3)4/h5-8,13-14,27H,9-12,15H2,1-4H3