(2-azanyl-4-oxidanyl-1-oxidanylidene-1,4-diphenyl-hexan-3-yl) 3-methoxybenzoate

Systemtic Name: (2-azanyl-4-oxidanyl-1-oxidanylidene-1,4-diphenyl-hexan-3-yl) 3-methoxybenzoate Openeye Name: [1-(1-amino-2-oxo-2-phenyl-ethyl)-2-hydroxy-2-phenyl-butyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid (2-amino-4-hydroxy-1-oxo-1,4-diphenylhexan-3-yl) ester IUPAC Name: (2-amino-4-hydroxy-1-oxo-1,4-diphenylhexan-3-yl) 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [1-(1-amino-2-keto-2-phenyl-ethyl)-2-hydroxy-2-phenyl-butyl] ester Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(C(C(=O)C2=CC=CC=C2)N)OC(=O)C3=CC(=CC=C3)OC)O

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(C(C(=O)C2=CC=CC=C2)N)OC(=O)C3=CC(=CC=C3)OC)O

InChI

InChI=1S/C26H27NO5/c1-3-26(30,20-14-8-5-9-15-20)24(22(27)23(28)18-11-6-4-7-12-18)32-25(29)19-13-10-16-21(17-19)31-2/h4-17,22,24,30H,3,27H2,1-2H3