ethanedioic acid; N-[(3-ethoxy-4-methoxy-phenyl)methyl]pentan-3-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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