1-cyano-3-phenyl-2-[6-(2-phenylethynyl)-3,4-dihydro-2H-chromen-4-yl]guanidine

Systemtic Name: 1-cyano-3-phenyl-2-[6-(2-phenylethynyl)-3,4-dihydro-2H-chromen-4-yl]guanidine Openeye Name: 1-cyano-3-phenyl-2-[6-(2-phenylethynyl)chroman-4-yl]guanidine CAS Name: 1-cyano-3-phenyl-2-[6-(2-phenylethynyl)-3,4-dihydro-2H-1-benzopyran-4-yl]guanidine IUPAC Name: 1-cyano-3-phenyl-2-[6-(2-phenylethynyl)-3,4-dihydro-2H-chromen-4-yl]guanidine Traditional Name: 1-cyano-3-phenyl-2-[6-(2-phenylethynyl)chroman-4-yl]guanidine Formula: C25H20N4O MolecularWeight: 392.4525

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C1N=C(NC#N)NC3=CC=CC=C3)C=C(C=C2)C#CC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(C1N=C(NC#N)NC3=CC=CC=C3)C=C(C=C2)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H20N4O/c26-18-27-25(28-21-9-5-2-6-10-21)29-23-15-16-30-24-14-13-20(17-22(23)24)12-11-19-7-3-1-4-8-19/h1-10,13-14,17,23H,15-16H2,(H2,27,28,29)