2-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(6-chloro-7-methyl-2-oxochromen-4-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C19H11ClN2O6 MolecularWeight: 398.75344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H11ClN2O6/c1-9-4-16-13(7-15(9)20)10(5-17(23)28-16)8-21-18(24)12-3-2-11(22(26)27)6-14(12)19(21)25/h2-7H,8H2,1H3