2-[4-azanyl-1-(furan-3-yl)butoxy]-4-chloranyl-benzenecarbonitrile; ethanedioic acid

Systemtic Name: 2-[4-azanyl-1-(furan-3-yl)butoxy]-4-chloranyl-benzenecarbonitrile; ethanedioic acid Openeye Name: 2-[4-amino-1-(3-furyl)butoxy]-4-chloro-benzonitrile; oxalic acid CAS Name: 2-[4-amino-1-(3-furanyl)butoxy]-4-chlorobenzonitrile; oxalic acid IUPAC Name: 2-[4-amino-1-(furan-3-yl)butoxy]-4-chlorobenzonitrile; oxalic acid Traditional Name: 2-[4-amino-1-(3-furyl)butoxy]-4-chloro-benzonitrile; oxalic acid Formula: C17H17ClN2O6 MolecularWeight: 380.77968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)OC(CCCN)C2=COC=C2)C#N.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)OC(CCCN)C2=COC=C2)C#N.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H15ClN2O2.C2H2O4/c16-13-4-3-11(9-18)15(8-13)20-14(2-1-6-17)12-5-7-19-10-12;3-1(4)2(5)6/h3-5,7-8,10,14H,1-2,6,17H2;(H,3,4)(H,5,6)