(3S)-N-[(E)-(1-methylindol-3-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-[(E)-(1-methylindol-3-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-[(E)-(1-methylindol-3-yl)methyleneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[(E)-(1-methyl-3-indolyl)methylideneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-[(E)-(1-methylindol-3-yl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-[(E)-(1-methylindol-3-yl)methyleneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=NNC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)/C=N/NC(=O)[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H17N3O3/c1-22-11-13(14-6-2-3-7-15(14)22)10-20-21-19(23)18-12-24-16-8-4-5-9-17(16)25-18/h2-11,18H,12H2,1H3,(H,21,23)/b20-10+/t18-/m0/s1