[(2S)-2-[bis(phenylmethyl)amino]oxy-3-methyl-butyl] 3-chloranylbenzoate

Systemtic Name: [(2S)-2-[bis(phenylmethyl)amino]oxy-3-methyl-butyl] 3-chloranylbenzoate Openeye Name: [(2S)-2-(dibenzylamino)oxy-3-methyl-butyl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [(2S)-2-[bis(phenylmethyl)amino]oxy-3-methylbutyl] ester IUPAC Name: [(2S)-2-(dibenzylamino)oxy-3-methylbutyl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [(2S)-2-(dibenzylamino)oxy-3-methyl-butyl] ester Formula: C26H28ClNO3 MolecularWeight: 437.95842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC(=O)C1=CC(=CC=C1)Cl)ON(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](COC(=O)C1=CC(=CC=C1)Cl)ON(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C26H28ClNO3/c1-20(2)25(19-30-26(29)23-14-9-15-24(27)16-23)31-28(17-21-10-5-3-6-11-21)18-22-12-7-4-8-13-22/h3-16,20,25H,17-19H2,1-2H3/t25-/m1/s1