[[(5R)-6-methoxy-6-oxidanylidene-5-(phenylmethoxycarbonylamino)hexyl]amino] benzoate

Systemtic Name: [[(5R)-6-methoxy-6-oxidanylidene-5-(phenylmethoxycarbonylamino)hexyl]amino] benzoate Openeye Name: [[(5R)-5-(benzyloxycarbonylamino)-6-methoxy-6-oxo-hexyl]amino] benzoate CAS Name: benzoic acid [[(5R)-6-methoxy-6-oxo-5-(phenylmethoxycarbonylamino)hexyl]amino] ester IUPAC Name: [[(5R)-6-methoxy-6-oxo-5-(phenylmethoxycarbonylamino)hexyl]amino] benzoate Traditional Name: benzoic acid [[(5R)-5-(benzyloxycarbonylamino)-6-keto-6-methoxy-hexyl]amino] ester Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCNOC(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H](CCCCNOC(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O6/c1-28-21(26)19(24-22(27)29-16-17-10-4-2-5-11-17)14-8-9-15-23-30-20(25)18-12-6-3-7-13-18/h2-7,10-13,19,23H,8-9,14-16H2,1H3,(H,24,27)/t19-/m1/s1