5-[2-[4-[4-(dimethylamino)-4-oxidanylidene-butyl]-7-nitro-1H-isochromen-3-yl]-4-nitro-phenyl]-N,N-dimethyl-5-oxidanylidene-pentanamide

Systemtic Name: 5-[2-[4-[4-(dimethylamino)-4-oxidanylidene-butyl]-7-nitro-1H-isochromen-3-yl]-4-nitro-phenyl]-N,N-dimethyl-5-oxidanylidene-pentanamide Openeye Name: 5-[2-[4-[4-(dimethylamino)-4-oxo-butyl]-7-nitro-1H-isochromen-3-yl]-4-nitro-phenyl]-N,N-dimethyl-5-oxo-pentanamide CAS Name: 5-[2-[4-[4-(dimethylamino)-4-oxobutyl]-7-nitro-1H-2-benzopyran-3-yl]-4-nitrophenyl]-N,N-dimethyl-5-oxopentanamide IUPAC Name: 5-[2-[4-[4-(dimethylamino)-4-oxobutyl]-7-nitro-1H-isochromen-3-yl]-4-nitrophenyl]-N,N-dimethyl-5-oxopentanamide Traditional Name: 5-[2-[4-[4-(dimethylamino)-4-keto-butyl]-7-nitro-1H-isochromen-3-yl]-4-nitro-phenyl]-5-keto-N,N-dimethyl-valeramide Formula: C28H32N4O8 MolecularWeight: 552.57568

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCCC1=C(OCC2=C1C=CC(=C2)[N+](=O)[O-])C3=C(C=CC(=C3)[N+](=O)[O-])C(=O)CCCC(=O)N(C)C

Isomeric SMILES

CN(C)C(=O)CCCC1=C(OCC2=C1C=CC(=C2)[N+](=O)[O-])C3=C(C=CC(=C3)[N+](=O)[O-])C(=O)CCCC(=O)N(C)C

InChI

InChI=1S/C28H32N4O8/c1-29(2)26(34)9-5-7-23-21-13-11-19(31(36)37)15-18(21)17-40-28(23)24-16-20(32(38)39)12-14-22(24)25(33)8-6-10-27(35)30(3)4/h11-16H,5-10,17H2,1-4H3