methyl 4-[1,1-bis[(1-oxidanyl-2-phenyl-ethyl)amino]propyl]benzoate

Systemtic Name: methyl 4-[1,1-bis[(1-oxidanyl-2-phenyl-ethyl)amino]propyl]benzoate Openeye Name: methyl 4-[1,1-bis[(1-hydroxy-2-phenyl-ethyl)amino]propyl]benzoate CAS Name: 4-[1,1-bis[(1-hydroxy-2-phenylethyl)amino]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1,1-bis[(1-hydroxy-2-phenylethyl)amino]propyl]benzoate Traditional Name: 4-[1,1-bis[(1-hydroxy-2-phenyl-ethyl)amino]propyl]benzoic acid methyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C(=O)OC)(NC(CC2=CC=CC=C2)O)NC(CC3=CC=CC=C3)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)C(=O)OC)(NC(CC2=CC=CC=C2)O)NC(CC3=CC=CC=C3)O

InChI

InChI=1S/C27H32N2O4/c1-3-27(23-16-14-22(15-17-23)26(32)33-2,28-24(30)18-20-10-6-4-7-11-20)29-25(31)19-21-12-8-5-9-13-21/h4-17,24-25,28-31H,3,18-19H2,1-2H3