ethyl 5-(5-azanyl-2-oxidanyl-phenyl)-1-(3-cyano-4-methyl-5-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(5-azanyl-2-oxidanyl-phenyl)-1-(3-cyano-4-methyl-5-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(5-amino-2-hydroxy-phenyl)-1-(3-cyano-4-methyl-5-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylate CAS Name: 5-(5-amino-2-hydroxyphenyl)-1-(3-cyano-4-methyl-5-phenyl-1H-pyrrol-2-yl)-2-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(5-amino-2-hydroxyphenyl)-1-(3-cyano-4-methyl-5-phenyl-1H-pyrrol-2-yl)-2-methylpyrrole-3-carboxylate Traditional Name: 5-(5-amino-2-hydroxy-phenyl)-1-(3-cyano-4-methyl-5-phenyl-1H-pyrrol-2-yl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=C(C=CC(=C2)N)O)C3=C(C(=C(N3)C4=CC=CC=C4)C)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=C(C=CC(=C2)N)O)C3=C(C(=C(N3)C4=CC=CC=C4)C)C#N)C

InChI

InChI=1S/C26H24N4O3/c1-4-33-26(32)19-13-22(20-12-18(28)10-11-23(20)31)30(16(19)3)25-21(14-27)15(2)24(29-25)17-8-6-5-7-9-17/h5-13,29,31H,4,28H2,1-3H3