methyl 9-(2-cyclopropylethynyl)-2-(2,6-dicyanophenyl)-1H-phenanthro[9,10-d]imidazole-6-carboxylate

Systemtic Name: methyl 9-(2-cyclopropylethynyl)-2-(2,6-dicyanophenyl)-1H-phenanthro[9,10-d]imidazole-6-carboxylate Openeye Name: methyl 9-(2-cyclopropylethynyl)-2-(2,6-dicyanophenyl)-1H-phenanthro[9,10-d]imidazole-6-carboxylate CAS Name: 9-(2-cyclopropylethynyl)-2-(2,6-dicyanophenyl)-1H-phenanthro[9,10-d]imidazole-6-carboxylic acid methyl ester IUPAC Name: methyl 9-(2-cyclopropylethynyl)-2-(2,6-dicyanophenyl)-1H-phenanthro[9,10-d]imidazole-6-carboxylate Traditional Name: 9-(2-cyclopropylethynyl)-2-(2,6-dicyanophenyl)-1H-phenanthr[9,10-d]imidazole-6-carboxylic acid methyl ester Formula: C30H18N4O2 MolecularWeight: 466.48952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C3=C(C4=C2C=C(C=C4)C#CC5CC5)NC(=N3)C6=C(C=CC=C6C#N)C#N

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C3=C(C4=C2C=C(C=C4)C#CC5CC5)NC(=N3)C6=C(C=CC=C6C#N)C#N

InChI

InChI=1S/C30H18N4O2/c1-36-30(35)19-10-12-23-25(14-19)24-13-18(8-7-17-5-6-17)9-11-22(24)27-28(23)34-29(33-27)26-20(15-31)3-2-4-21(26)16-32/h2-4,9-14,17H,5-6H2,1H3,(H,33,34)