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

Systemtic Name: tert-butyl (4S)-4-[bis(phenylmethyl)amino]-3-oxidanylidene-5-(4-phenylmethoxyphenyl)pentanoate Openeye Name: tert-butyl (4S)-5-(4-benzyloxyphenyl)-4-(dibenzylamino)-3-oxo-pentanoate CAS Name: (4S)-4-[bis(phenylmethyl)amino]-3-oxo-5-(4-phenylmethoxyphenyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-(dibenzylamino)-3-oxo-5-(4-phenylmethoxyphenyl)pentanoate Traditional Name: (4S)-5-(4-benzoxyphenyl)-4-(dibenzylamino)-3-keto-valeric acid tert-butyl ester Formula: C36H39NO4 MolecularWeight: 549.69916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)CC(=O)[C@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C36H39NO4/c1-36(2,3)41-35(39)24-34(38)33(23-28-19-21-32(22-20-28)40-27-31-17-11-6-12-18-31)37(25-29-13-7-4-8-14-29)26-30-15-9-5-10-16-30/h4-22,33H,23-27H2,1-3H3/t33-/m0/s1