ethyl 4-(7,7-dimethyl-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-benzoate

Systemtic Name: ethyl 4-(7,7-dimethyl-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-benzoate Openeye Name: ethyl 4-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-benzoate CAS Name: 4-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxybenzoate Traditional Name: 4-(6-keto-7,7-dimethyl-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-benzoic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C2=NC3=C(N2)C=C4C(=C3)NC(=O)C4(C)C)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C2=NC3=C(N2)C=C4C(=C3)NC(=O)C4(C)C)OC

InChI

InChI=1S/C21H21N3O4/c1-5-28-19(25)11-6-7-12(17(8-11)27-4)18-22-15-9-13-14(10-16(15)23-18)24-20(26)21(13,2)3/h6-10H,5H2,1-4H3,(H,22,23)(H,24,26)