tert-butyl (4S)-4-[bis(phenylmethyl)amino]-2-bromanyl-3-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: tert-butyl (4S)-4-[bis(phenylmethyl)amino]-2-bromanyl-3-oxidanylidene-5-phenyl-pentanoate Openeye Name: tert-butyl (4S)-2-bromo-4-(dibenzylamino)-3-oxo-5-phenyl-pentanoate CAS Name: (4S)-4-[bis(phenylmethyl)amino]-2-bromo-3-oxo-5-phenylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-2-bromo-4-(dibenzylamino)-3-oxo-5-phenylpentanoate Traditional Name: (4S)-2-bromo-4-(dibenzylamino)-3-keto-5-phenyl-valeric acid tert-butyl ester Formula: C29H32BrNO3 MolecularWeight: 522.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)C(CC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=O)[C@H](CC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C29H32BrNO3/c1-29(2,3)34-28(33)26(30)27(32)25(19-22-13-7-4-8-14-22)31(20-23-15-9-5-10-16-23)21-24-17-11-6-12-18-24/h4-18,25-26H,19-21H2,1-3H3/t25-,26?/m0/s1