N-(4-methyl-2-nitro-phenyl)-1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-isopropyl-N-(4-methyl-2-nitro-phenyl)-1-oxo-isochromane-3-carboxamide CAS Name: N-(4-methyl-2-nitrophenyl)-1-oxo-6-propan-2-yl-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-1-oxo-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-isopropyl-1-keto-N-(4-methyl-2-nitro-phenyl)isochroman-3-carboxamide Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5/c1-11(2)13-5-6-15-14(9-13)10-18(27-20(15)24)19(23)21-16-7-4-12(3)8-17(16)22(25)26/h4-9,11,18H,10H2,1-3H3,(H,21,23)