[1-(butylamino)-2-oxidanyl-propyl] benzoate

Systemtic Name: [1-(butylamino)-2-oxidanyl-propyl] benzoate Openeye Name: [1-(butylamino)-2-hydroxy-propyl] benzoate CAS Name: benzoic acid [1-(butylamino)-2-hydroxypropyl] ester IUPAC Name: [1-(butylamino)-2-hydroxypropyl] benzoate Traditional Name: benzoic acid [1-(butylamino)-2-hydroxy-propyl] ester Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C(C)O)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCNC(C(C)O)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H21NO3/c1-3-4-10-15-13(11(2)16)18-14(17)12-8-6-5-7-9-12/h5-9,11,13,15-16H,3-4,10H2,1-2H3