ethyl 3-cyano-2,5-dimethyl-1,7-diphenyl-pyrrolo[3,2-b]pyridine-6-carboxylate

Systemtic Name: ethyl 3-cyano-2,5-dimethyl-1,7-diphenyl-pyrrolo[3,2-b]pyridine-6-carboxylate Openeye Name: ethyl 3-cyano-2,5-dimethyl-1,7-diphenyl-pyrrolo[3,2-b]pyridine-6-carboxylate CAS Name: 3-cyano-2,5-dimethyl-1,7-diphenyl-6-pyrrolo[3,2-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2,5-dimethyl-1,7-diphenylpyrrolo[3,2-b]pyridine-6-carboxylate Traditional Name: 3-cyano-2,5-dimethyl-1,7-diphenyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid ethyl ester Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C(N2C3=CC=CC=C3)C)C#N)N=C1C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C(N2C3=CC=CC=C3)C)C#N)N=C1C)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2/c1-4-30-25(29)21-16(2)27-23-20(15-26)17(3)28(19-13-9-6-10-14-19)24(23)22(21)18-11-7-5-8-12-18/h5-14H,4H2,1-3H3