3-chloranyl-4-methoxy-N-(pyridin-4-ylmethyl)aniline; ethanedioic acid

Systemtic Name: 3-chloranyl-4-methoxy-N-(pyridin-4-ylmethyl)aniline; ethanedioic acid Openeye Name: 3-chloro-4-methoxy-N-(4-pyridylmethyl)aniline; oxalic acid CAS Name: 3-chloro-4-methoxy-N-(pyridin-4-ylmethyl)aniline; oxalic acid IUPAC Name: 3-chloro-4-methoxy-N-(pyridin-4-ylmethyl)aniline; oxalic acid Traditional Name: (3-chloro-4-methoxy-phenyl)-(4-pyridylmethyl)amine; oxalic acid Formula: C15H15ClN2O5 MolecularWeight: 338.743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC2=CC=NC=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)NCC2=CC=NC=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H13ClN2O.C2H2O4/c1-17-13-3-2-11(8-12(13)14)16-9-10-4-6-15-7-5-10;3-1(4)2(5)6/h2-8,16H,9H2,1H3;(H,3,4)(H,5,6)