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

Systemtic Name: 2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]-4-nitro-isoindoline-1,3-quinone Formula: C22H18N2O6 MolecularWeight: 406.38812

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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(=CC=C4)[N+](=O)[O-])C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O6/c1-11(2)15-9-16-13(8-19(25)30-18(16)7-12(15)3)10-23-21(26)14-5-4-6-17(24(28)29)20(14)22(23)27/h4-9,11H,10H2,1-3H3