6-ethyl-N-(4-methoxy-2-nitro-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 6-ethyl-N-(4-methoxy-2-nitro-phenyl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-ethyl-N-(4-methoxy-2-nitro-phenyl)-1-oxo-isochromane-3-carboxamide CAS Name: 6-ethyl-N-(4-methoxy-2-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-ethyl-N-(4-methoxy-2-nitrophenyl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-ethyl-1-keto-N-(4-methoxy-2-nitro-phenyl)isochroman-3-carboxamide Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O6/c1-3-11-4-6-14-12(8-11)9-17(27-19(14)23)18(22)20-15-7-5-13(26-2)10-16(15)21(24)25/h4-8,10,17H,3,9H2,1-2H3,(H,20,22)