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

Systemtic Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-3-morpholino-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-3-(4-morpholinyl)-3-oxoprop-1-enyl]benzoate IUPAC Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-3-morpholin-4-yl-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-2-(1H-benzimidazol-2-yl)-3-keto-3-morpholino-prop-1-enyl]benzoate Formula: C21H18N3O4- MolecularWeight: 376.38532

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1COCCN1C(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H19N3O4/c25-20(24-9-11-28-12-10-24)16(13-14-5-7-15(8-6-14)21(26)27)19-22-17-3-1-2-4-18(17)23-19/h1-8,13H,9-12H2,(H,22,23)(H,26,27)/p-1/b16-13+