methyl 3-oxidanyl-3-(2-phenylmethoxyphenyl)-2-[[(phenylmethyl)amino]methyl]propanoate

Systemtic Name: methyl 3-oxidanyl-3-(2-phenylmethoxyphenyl)-2-[[(phenylmethyl)amino]methyl]propanoate Openeye Name: methyl 2-[(benzylamino)methyl]-3-(2-benzyloxyphenyl)-3-hydroxy-propanoate CAS Name: 3-hydroxy-3-(2-phenylmethoxyphenyl)-2-[[(phenylmethyl)amino]methyl]propanoic acid methyl ester IUPAC Name: methyl 2-[(benzylamino)methyl]-3-hydroxy-3-(2-phenylmethoxyphenyl)propanoate Traditional Name: 3-(2-benzoxyphenyl)-2-[(benzylamino)methyl]-3-hydroxy-propionic acid methyl ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNCC1=CC=CC=C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C(CNCC1=CC=CC=C1)C(C2=CC=CC=C2OCC3=CC=CC=C3)O

InChI

InChI=1S/C25H27NO4/c1-29-25(28)22(17-26-16-19-10-4-2-5-11-19)24(27)21-14-8-9-15-23(21)30-18-20-12-6-3-7-13-20/h2-15,22,24,26-27H,16-18H2,1H3