N-[bis(azanyl)methylidene]-2-(2-butoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(2-butoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(2-butoxyphenyl)-N-(diaminomethylene)quinoline-4-carboxamide CAS Name: 2-(2-butoxyphenyl)-N-(diaminomethylidene)-4-quinolinecarboxamide IUPAC Name: 2-(2-butoxyphenyl)-N-(diaminomethylidene)quinoline-4-carboxamide Traditional Name: 2-(2-butoxyphenyl)-N-(diaminomethylene)cinchoninamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

Isomeric SMILES

CCCCOC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

InChI

InChI=1S/C21H22N4O2/c1-2-3-12-27-19-11-7-5-9-15(19)18-13-16(20(26)25-21(22)23)14-8-4-6-10-17(14)24-18/h4-11,13H,2-3,12H2,1H3,(H4,22,23,25,26)