ethanedioic acid; 2-(heptan-2-ylamino)-1-phenyl-ethanol

Systemtic Name: ethanedioic acid; 2-(heptan-2-ylamino)-1-phenyl-ethanol Openeye Name: 2-(1-methylhexylamino)-1-phenyl-ethanol; oxalic acid CAS Name: 2-(heptan-2-ylamino)-1-phenylethanol; oxalic acid IUPAC Name: 2-(heptan-2-ylamino)-1-phenylethanol; oxalic acid Traditional Name: 2-(1-methylhexylamino)-1-phenyl-ethanol; oxalic acid Formula: C17H27NO5 MolecularWeight: 325.39998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NCC(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCC(C)NCC(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H25NO.C2H2O4/c1-3-4-6-9-13(2)16-12-15(17)14-10-7-5-8-11-14;3-1(4)2(5)6/h5,7-8,10-11,13,15-17H,3-4,6,9,12H2,1-2H3;(H,3,4)(H,5,6)