ethanedioic acid; 4-(2-methylpropylamino)-1-phenyl-butan-1-ol

Systemtic Name: ethanedioic acid; 4-(2-methylpropylamino)-1-phenyl-butan-1-ol Openeye Name: 4-(isobutylamino)-1-phenyl-butan-1-ol; oxalic acid CAS Name: 4-(2-methylpropylamino)-1-phenyl-1-butanol; oxalic acid IUPAC Name: 4-(2-methylpropylamino)-1-phenylbutan-1-ol; oxalic acid Traditional Name: 4-(isobutylamino)-1-phenyl-butan-1-ol; oxalic acid Formula: C16H25NO5 MolecularWeight: 311.3734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO.C2H2O4/c1-12(2)11-15-10-6-9-14(16)13-7-4-3-5-8-13;3-1(4)2(5)6/h3-5,7-8,12,14-16H,6,9-11H2,1-2H3;(H,3,4)(H,5,6)