tert-butyl 3-[3-oxidanyl-2-[(phenylmethyl)amino]propyl]benzoate

Systemtic Name: tert-butyl 3-[3-oxidanyl-2-[(phenylmethyl)amino]propyl]benzoate Openeye Name: tert-butyl 3-[2-(benzylamino)-3-hydroxy-propyl]benzoate CAS Name: 3-[3-hydroxy-2-[(phenylmethyl)amino]propyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(benzylamino)-3-hydroxypropyl]benzoate Traditional Name: 3-[2-(benzylamino)-3-hydroxy-propyl]benzoic acid tert-butyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=CC=C1)CC(CO)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=CC=C1)CC(CO)NCC2=CC=CC=C2

InChI

InChI=1S/C21H27NO3/c1-21(2,3)25-20(24)18-11-7-10-17(12-18)13-19(15-23)22-14-16-8-5-4-6-9-16/h4-12,19,22-23H,13-15H2,1-3H3