ethanedioic acid; 2-(pentylamino)-1-phenyl-ethanol

Systemtic Name: ethanedioic acid; 2-(pentylamino)-1-phenyl-ethanol Openeye Name: oxalic acid; 2-(pentylamino)-1-phenyl-ethanol CAS Name: oxalic acid; 2-(pentylamino)-1-phenylethanol IUPAC Name: oxalic acid; 2-(pentylamino)-1-phenylethanol Traditional Name: 2-(amylamino)-1-phenyl-ethanol; oxalic acid Formula: C15H23NO5 MolecularWeight: 297.34682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCNCC(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H21NO.C2H2O4/c1-2-3-7-10-14-11-13(15)12-8-5-4-6-9-12;3-1(4)2(5)6/h4-6,8-9,13-15H,2-3,7,10-11H2,1H3;(H,3,4)(H,5,6)