ethanedioic acid; 2-methyl-N-(phenylmethyl)propan-1-amine

Systemtic Name: ethanedioic acid; 2-methyl-N-(phenylmethyl)propan-1-amine Openeye Name: N-benzyl-2-methyl-propan-1-amine; oxalic acid CAS Name: 2-methyl-N-(phenylmethyl)-1-propanamine; oxalic acid IUPAC Name: N-benzyl-2-methylpropan-1-amine; oxalic acid Traditional Name: benzyl(isobutyl)amine; oxalic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=CC=CC=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)CNCC1=CC=CC=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H17N.C2H2O4/c1-10(2)8-12-9-11-6-4-3-5-7-11;3-1(4)2(5)6/h3-7,10,12H,8-9H2,1-2H3;(H,3,4)(H,5,6)