methyl (2S)-6-azanyl-2-[bis[(4-phenylmethoxyphenyl)methyl]amino]hexanoate

Systemtic Name: methyl (2S)-6-azanyl-2-[bis[(4-phenylmethoxyphenyl)methyl]amino]hexanoate Openeye Name: methyl (2S)-6-amino-2-[bis[(4-benzyloxyphenyl)methyl]amino]hexanoate CAS Name: (2S)-6-amino-2-[bis[(4-phenylmethoxyphenyl)methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-amino-2-[bis[(4-phenylmethoxyphenyl)methyl]amino]hexanoate Traditional Name: (2S)-6-amino-2-[bis(4-benzoxybenzyl)amino]hexanoic acid methyl ester Formula: C35H40N2O4 MolecularWeight: 552.7031

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCN)N(CC1=CC=C(C=C1)OCC2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](CCCCN)N(CC1=CC=C(C=C1)OCC2=CC=CC=C2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C35H40N2O4/c1-39-35(38)34(14-8-9-23-36)37(24-28-15-19-32(20-16-28)40-26-30-10-4-2-5-11-30)25-29-17-21-33(22-18-29)41-27-31-12-6-3-7-13-31/h2-7,10-13,15-22,34H,8-9,14,23-27,36H2,1H3/t34-/m0/s1