ethanedioic acid; N-methyl-3-(2-nitrophenoxy)-3-phenyl-propan-1-amine

Systemtic Name: ethanedioic acid; N-methyl-3-(2-nitrophenoxy)-3-phenyl-propan-1-amine Openeye Name: N-methyl-3-(2-nitrophenoxy)-3-phenyl-propan-1-amine; oxalic acid CAS Name: N-methyl-3-(2-nitrophenoxy)-3-phenyl-1-propanamine; oxalic acid IUPAC Name: N-methyl-3-(2-nitrophenoxy)-3-phenylpropan-1-amine; oxalic acid Traditional Name: methyl-[3-(2-nitrophenoxy)-3-phenyl-propyl]amine; oxalic acid Formula: C18H20N2O7 MolecularWeight: 376.3606

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1=CC=CC=C1)OC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CNCCC(C1=CC=CC=C1)OC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C16H18N2O3.C2H2O4/c1-17-12-11-15(13-7-3-2-4-8-13)21-16-10-6-5-9-14(16)18(19)20;3-1(4)2(5)6/h2-10,15,17H,11-12H2,1H3;(H,3,4)(H,5,6)