ethyl 2-[3,4-bis(oxidanyl)hexan-3-ylamino]benzoate

Systemtic Name: ethyl 2-[3,4-bis(oxidanyl)hexan-3-ylamino]benzoate Openeye Name: ethyl 2-[(1-ethyl-1,2-dihydroxy-butyl)amino]benzoate CAS Name: 2-(3,4-dihydroxyhexan-3-ylamino)benzoic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dihydroxyhexan-3-ylamino)benzoate Traditional Name: 2-[(1-ethyl-1,2-dihydroxy-butyl)amino]benzoic acid ethyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC)(NC1=CC=CC=C1C(=O)OCC)O)O

Isomeric SMILES

CCC(C(CC)(NC1=CC=CC=C1C(=O)OCC)O)O

InChI

InChI=1S/C15H23NO4/c1-4-13(17)15(19,5-2)16-12-10-8-7-9-11(12)14(18)20-6-3/h7-10,13,16-17,19H,4-6H2,1-3H3