(3S)-N-(1H-benzimidazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3S)-N-(1H-benzimidazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-N-(1H-benzimidazol-2-yl)-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-(1H-benzimidazol-2-yl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-(1H-benzimidazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-N-(1H-benzimidazol-2-yl)-1-keto-isochroman-3-carboxamide Formula: C17H13N3O3 MolecularWeight: 307.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C17H13N3O3/c21-15(20-17-18-12-7-3-4-8-13(12)19-17)14-9-10-5-1-2-6-11(10)16(22)23-14/h1-8,14H,9H2,(H2,18,19,20,21)/t14-/m0/s1