methyl (2R,4S,5S)-5-[bis(phenylmethyl)amino]-4-oxidanyl-6-phenyl-2-propyl-hexanoate

Systemtic Name: methyl (2R,4S,5S)-5-[bis(phenylmethyl)amino]-4-oxidanyl-6-phenyl-2-propyl-hexanoate Openeye Name: methyl (2R,4S,5S)-5-(dibenzylamino)-4-hydroxy-6-phenyl-2-propyl-hexanoate CAS Name: (2R,4S,5S)-5-[bis(phenylmethyl)amino]-4-hydroxy-6-phenyl-2-propylhexanoic acid methyl ester IUPAC Name: methyl (2R,4S,5S)-5-(dibenzylamino)-4-hydroxy-6-phenyl-2-propylhexanoate Traditional Name: (2R,4S,5S)-5-(dibenzylamino)-4-hydroxy-6-phenyl-2-propyl-hexanoic acid methyl ester Formula: C30H37NO3 MolecularWeight: 459.61968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H37NO3/c1-3-13-27(30(33)34-2)21-29(32)28(20-24-14-7-4-8-15-24)31(22-25-16-9-5-10-17-25)23-26-18-11-6-12-19-26/h4-12,14-19,27-29,32H,3,13,20-23H2,1-2H3/t27-,28+,29+/m1/s1