[(1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propyl] 3-methoxypropanoate

Systemtic Name: [(1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propyl] 3-methoxypropanoate Openeye Name: [(1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propyl] 3-methoxypropanoate CAS Name: 3-methoxypropanoic acid [(1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propyl] ester IUPAC Name: [(1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propyl] 3-methoxypropanoate Traditional Name: 3-methoxypropionic acid [(1S,2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propyl] ester Formula: C17H26ClNO3 MolecularWeight: 327.84624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC(=CC=C1)Cl)OC(=O)CCOC)NC(C)(C)C

Isomeric SMILES

C[C@@H]([C@H](C1=CC(=CC=C1)Cl)OC(=O)CCOC)NC(C)(C)C

InChI

InChI=1S/C17H26ClNO3/c1-12(19-17(2,3)4)16(22-15(20)9-10-21-5)13-7-6-8-14(18)11-13/h6-8,11-12,16,19H,9-10H2,1-5H3/t12-,16+/m0/s1