tert-butyl 4-[4-[4-(3-oxidanylpiperidin-1-yl)carbonylphenyl]butyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[4-(3-oxidanylpiperidin-1-yl)carbonylphenyl]butyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[4-(3-hydroxypiperidine-1-carbonyl)phenyl]butyl]piperidine-1-carboxylate CAS Name: 4-[4-[4-[(3-hydroxy-1-piperidinyl)-oxomethyl]phenyl]butyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[4-(3-hydroxypiperidine-1-carbonyl)phenyl]butyl]piperidine-1-carboxylate Traditional Name: 4-[4-[4-(3-hydroxypiperidine-1-carbonyl)phenyl]butyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H40N2O4 MolecularWeight: 444.6068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCCCC2=CC=C(C=C2)C(=O)N3CCCC(C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCCCC2=CC=C(C=C2)C(=O)N3CCCC(C3)O

InChI

InChI=1S/C26H40N2O4/c1-26(2,3)32-25(31)27-17-14-21(15-18-27)8-5-4-7-20-10-12-22(13-11-20)24(30)28-16-6-9-23(29)19-28/h10-13,21,23,29H,4-9,14-19H2,1-3H3