diethyl 2-[[[4-(1H-benzimidazol-2-yl)phenyl]amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[[4-(1H-benzimidazol-2-yl)phenyl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[4-(1H-benzimidazol-2-yl)anilino]methylene]propanedioate CAS Name: 2-[[4-(1H-benzimidazol-2-yl)anilino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(1H-benzimidazol-2-yl)anilino]methylidene]propanedioate Traditional Name: 2-[[4-(1H-benzimidazol-2-yl)anilino]methylene]malonic acid diethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CC=C(C=C1)C2=NC3=CC=CC=C3N2)C(=O)OCC

InChI

InChI=1S/C21H21N3O4/c1-3-27-20(25)16(21(26)28-4-2)13-22-15-11-9-14(10-12-15)19-23-17-7-5-6-8-18(17)24-19/h5-13,22H,3-4H2,1-2H3,(H,23,24)