ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]propanoylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]propanoylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]propanoylamino]benzofuran-2-carboxylate CAS Name: 5-[[2-[4-(5-cyano-1H-indol-3-yl)butylamino]-1-oxopropyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]propanoylamino]-1-benzofuran-2-carboxylate Traditional Name: 5-[2-[4-(5-cyano-1H-indol-3-yl)butylamino]propanoylamino]coumarilic acid ethyl ester Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)NC(=O)C(C)NCCCCC3=CNC4=C3C=C(C=C4)C#N

Isomeric SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)NC(=O)C(C)NCCCCC3=CNC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C27H28N4O4/c1-3-34-27(33)25-14-20-13-21(8-10-24(20)35-25)31-26(32)17(2)29-11-5-4-6-19-16-30-23-9-7-18(15-28)12-22(19)23/h7-10,12-14,16-17,29-30H,3-6,11H2,1-2H3,(H,31,32)