4-[4-(diphenylmethyl)oxypiperidin-1-yl]butyl 4-tert-butylbenzoate

Systemtic Name: 4-[4-(diphenylmethyl)oxypiperidin-1-yl]butyl 4-tert-butylbenzoate Openeye Name: 4-(4-benzhydryloxy-1-piperidyl)butyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid 4-[4-(diphenylmethyl)oxy-1-piperidinyl]butyl ester IUPAC Name: 4-(4-benzhydryloxypiperidin-1-yl)butyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid 4-(4-benzhydryloxypiperidino)butyl ester Formula: C33H41NO3 MolecularWeight: 499.68354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCCCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCCCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C33H41NO3/c1-33(2,3)29-18-16-28(17-19-29)32(35)36-25-11-10-22-34-23-20-30(21-24-34)37-31(26-12-6-4-7-13-26)27-14-8-5-9-15-27/h4-9,12-19,30-31H,10-11,20-25H2,1-3H3