ethanedioic acid; N-methyl-4-(3-phenoxyphenoxy)butan-1-amine

Systemtic Name: ethanedioic acid; N-methyl-4-(3-phenoxyphenoxy)butan-1-amine Openeye Name: N-methyl-4-(3-phenoxyphenoxy)butan-1-amine; oxalic acid CAS Name: N-methyl-4-(3-phenoxyphenoxy)-1-butanamine; oxalic acid IUPAC Name: N-methyl-4-(3-phenoxyphenoxy)butan-1-amine; oxalic acid Traditional Name: methyl-[4-(3-phenoxyphenoxy)butyl]amine; oxalic acid Formula: C19H23NO6 MolecularWeight: 361.38902

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCOC1=CC=CC(=C1)OC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CNCCCCOC1=CC=CC(=C1)OC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21NO2.C2H2O4/c1-18-12-5-6-13-19-16-10-7-11-17(14-16)20-15-8-3-2-4-9-15;3-1(4)2(5)6/h2-4,7-11,14,18H,5-6,12-13H2,1H3;(H,3,4)(H,5,6)