ethanedioic acid; N-methyl-N-phenethyl-hexan-1-amine

Systemtic Name: ethanedioic acid; N-methyl-N-phenethyl-hexan-1-amine Openeye Name: N-methyl-N-phenethyl-hexan-1-amine; oxalic acid CAS Name: N-methyl-N-phenethyl-1-hexanamine; oxalic acid IUPAC Name: N-methyl-N-phenethylhexan-1-amine; oxalic acid Traditional Name: hexyl-methyl-phenethyl-amine; oxalic acid Formula: C17H27NO4 MolecularWeight: 309.40058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C)CCC1=CC=CC=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCN(C)CCC1=CC=CC=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H25N.C2H2O4/c1-3-4-5-9-13-16(2)14-12-15-10-7-6-8-11-15;3-1(4)2(5)6/h6-8,10-11H,3-5,9,12-14H2,1-2H3;(H,3,4)(H,5,6)