ethyl (3S,4S)-4-[bis(phenylmethyl)amino]-3-oxidanyl-5-phenylmethoxy-pentanoate

Systemtic Name: ethyl (3S,4S)-4-[bis(phenylmethyl)amino]-3-oxidanyl-5-phenylmethoxy-pentanoate Openeye Name: ethyl (3S,4S)-5-benzyloxy-4-(dibenzylamino)-3-hydroxy-pentanoate CAS Name: (3S,4S)-4-[bis(phenylmethyl)amino]-3-hydroxy-5-phenylmethoxypentanoic acid ethyl ester IUPAC Name: ethyl (3S,4S)-4-(dibenzylamino)-3-hydroxy-5-phenylmethoxypentanoate Traditional Name: (3S,4S)-5-benzoxy-4-(dibenzylamino)-3-hydroxy-valeric acid ethyl ester Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(COCC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C[C@@H]([C@H](COCC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C28H33NO4/c1-2-33-28(31)18-27(30)26(22-32-21-25-16-10-5-11-17-25)29(19-23-12-6-3-7-13-23)20-24-14-8-4-9-15-24/h3-17,26-27,30H,2,18-22H2,1H3/t26-,27-/m0/s1