ethanedioic acid; 2-[(2-oxidanyl-2-phenyl-ethyl)amino]butan-1-ol

Systemtic Name: ethanedioic acid; 2-[(2-oxidanyl-2-phenyl-ethyl)amino]butan-1-ol Openeye Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]butan-1-ol; oxalic acid CAS Name: 2-[(2-hydroxy-2-phenylethyl)amino]-1-butanol; oxalic acid IUPAC Name: 2-[(2-hydroxy-2-phenylethyl)amino]butan-1-ol; oxalic acid Traditional Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]butan-1-ol; oxalic acid Formula: C14H21NO6 MolecularWeight: 299.31964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CO)NCC(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H19NO2.C2H2O4/c1-2-11(9-14)13-8-12(15)10-6-4-3-5-7-10;3-1(4)2(5)6/h3-7,11-15H,2,8-9H2,1H3;(H,3,4)(H,5,6)