N-[(2,4-dimethoxy-3-methyl-phenyl)methyl]pentan-3-amine; ethanedioic acid

Systemtic Name: N-[(2,4-dimethoxy-3-methyl-phenyl)methyl]pentan-3-amine; ethanedioic acid Openeye Name: N-[(2,4-dimethoxy-3-methyl-phenyl)methyl]pentan-3-amine; oxalic acid CAS Name: N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3-pentanamine; oxalic acid IUPAC Name: N-[(2,4-dimethoxy-3-methylphenyl)methyl]pentan-3-amine; oxalic acid Traditional Name: (2,4-dimethoxy-3-methyl-benzyl)-(1-ethylpropyl)amine; oxalic acid Formula: C17H27NO6 MolecularWeight: 341.39938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC1=C(C(=C(C=C1)OC)C)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CC)NCC1=C(C(=C(C=C1)OC)C)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H25NO2.C2H2O4/c1-6-13(7-2)16-10-12-8-9-14(17-4)11(3)15(12)18-5;3-1(4)2(5)6/h8-9,13,16H,6-7,10H2,1-5H3;(H,3,4)(H,5,6)