ethanedioic acid; 2-(pentan-3-ylamino)-3-phenyl-propan-1-ol

Systemtic Name: ethanedioic acid; 2-(pentan-3-ylamino)-3-phenyl-propan-1-ol Openeye Name: 2-(1-ethylpropylamino)-3-phenyl-propan-1-ol; oxalic acid CAS Name: oxalic acid; 2-(pentan-3-ylamino)-3-phenyl-1-propanol IUPAC Name: oxalic acid; 2-(pentan-3-ylamino)-3-phenylpropan-1-ol Traditional Name: 2-(1-ethylpropylamino)-3-phenyl-propan-1-ol; oxalic acid Formula: C16H25NO5 MolecularWeight: 311.3734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(CC1=CC=CC=C1)CO.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CC)NC(CC1=CC=CC=C1)CO.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H23NO.C2H2O4/c1-3-13(4-2)15-14(11-16)10-12-8-6-5-7-9-12;3-1(4)2(5)6/h5-9,13-16H,3-4,10-11H2,1-2H3;(H,3,4)(H,5,6)