4-(4-phenylmethoxypiperidin-1-yl)butyl 4-tert-butylbenzoate

Systemtic Name: 4-(4-phenylmethoxypiperidin-1-yl)butyl 4-tert-butylbenzoate Openeye Name: 4-(4-benzyloxy-1-piperidyl)butyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid 4-(4-phenylmethoxy-1-piperidinyl)butyl ester IUPAC Name: 4-(4-phenylmethoxypiperidin-1-yl)butyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid 4-(4-benzoxypiperidino)butyl ester Formula: C27H37NO3 MolecularWeight: 423.58758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCCCCN2CCC(CC2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCCCCN2CCC(CC2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H37NO3/c1-27(2,3)24-13-11-23(12-14-24)26(29)30-20-8-7-17-28-18-15-25(16-19-28)31-21-22-9-5-4-6-10-22/h4-6,9-14,25H,7-8,15-21H2,1-3H3