methyl 4-[2-(1H-benzimidazol-2-yl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[2-(1H-benzimidazol-2-yl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[2-(1H-benzimidazol-2-yl)-3-morpholino-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[2-(1H-benzimidazol-2-yl)-3-(4-morpholinyl)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(1H-benzimidazol-2-yl)-3-morpholin-4-yl-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[2-(1H-benzimidazol-2-yl)-3-keto-3-morpholino-prop-1-enyl]benzoic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4

InChI

InChI=1S/C22H21N3O4/c1-28-22(27)16-8-6-15(7-9-16)14-17(21(26)25-10-12-29-13-11-25)20-23-18-4-2-3-5-19(18)24-20/h2-9,14H,10-13H2,1H3,(H,23,24)