ethanedioic acid; 2-methoxy-N-(naphthalen-1-ylmethyl)-5-nitro-aniline

Systemtic Name: ethanedioic acid; 2-methoxy-N-(naphthalen-1-ylmethyl)-5-nitro-aniline Openeye Name: 2-methoxy-N-(1-naphthylmethyl)-5-nitro-aniline; oxalic acid CAS Name: 2-methoxy-N-(1-naphthalenylmethyl)-5-nitroaniline; oxalic acid IUPAC Name: 2-methoxy-N-(naphthalen-1-ylmethyl)-5-nitroaniline; oxalic acid Traditional Name: (2-methoxy-5-nitro-phenyl)-(1-naphthylmethyl)amine; oxalic acid Formula: C20H18N2O7 MolecularWeight: 398.36612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H16N2O3.C2H2O4/c1-23-18-10-9-15(20(21)22)11-17(18)19-12-14-7-4-6-13-5-2-3-8-16(13)14;3-1(4)2(5)6/h2-11,19H,12H2,1H3;(H,3,4)(H,5,6)