N-[(E)-1-(5-bromanyl-2-butoxy-phenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine; ethanedioic acid

Systemtic Name: N-[(E)-1-(5-bromanyl-2-butoxy-phenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine; ethanedioic acid Openeye Name: N-[(E)-1-(5-bromo-2-butoxy-phenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine; oxalic acid CAS Name: N-[(E)-1-(5-bromo-2-butoxyphenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine; oxalic acid IUPAC Name: N-[(E)-1-(5-bromo-2-butoxyphenyl)ethylideneamino]-4,5-dihydro-1H-imidazol-2-amine; oxalic acid Traditional Name: [(E)-1-(5-bromo-2-butoxy-phenyl)ethylideneamino]-(2-imidazolin-2-yl)amine; oxalic acid Formula: C17H23BrN4O5 MolecularWeight: 443.29232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=NNC2=NCCN2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)/C(=N/NC2=NCCN2)/C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H21BrN4O.C2H2O4/c1-3-4-9-21-14-6-5-12(16)10-13(14)11(2)19-20-15-17-7-8-18-15;3-1(4)2(5)6/h5-6,10H,3-4,7-9H2,1-2H3,(H2,17,18,20);(H,3,4)(H,5,6)/b19-11+;