3-(benzotriazol-1-yl)-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)propanamide

Systemtic Name: 3-(benzotriazol-1-yl)-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)propanamide Openeye Name: 3-(benzotriazol-1-yl)-N-(1-oxo-3H-isobenzofuran-5-yl)propanamide CAS Name: 3-(1-benzotriazolyl)-N-(1-oxo-3H-isobenzofuran-5-yl)propanamide IUPAC Name: 3-(benzotriazol-1-yl)-N-(1-oxo-3H-2-benzofuran-5-yl)propanamide Traditional Name: 3-(benzotriazol-1-yl)-N-(1-ketophthalan-5-yl)propionamide Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)NC(=O)CCN3C4=CC=CC=C4N=N3)C(=O)O1

Isomeric SMILES

C1C2=C(C=CC(=C2)NC(=O)CCN3C4=CC=CC=C4N=N3)C(=O)O1

InChI

InChI=1S/C17H14N4O3/c22-16(7-8-21-15-4-2-1-3-14(15)19-20-21)18-12-5-6-13-11(9-12)10-24-17(13)23/h1-6,9H,7-8,10H2,(H,18,22)