3-[(2,4-dinitrophenoxy)methyl]-5-methoxy-1,2-dimethyl-indole-4,7-dione

Systemtic Name: 3-[(2,4-dinitrophenoxy)methyl]-5-methoxy-1,2-dimethyl-indole-4,7-dione Openeye Name: 3-[(2,4-dinitrophenoxy)methyl]-5-methoxy-1,2-dimethyl-indole-4,7-dione CAS Name: 3-[(2,4-dinitrophenoxy)methyl]-5-methoxy-1,2-dimethylindole-4,7-dione IUPAC Name: 3-[(2,4-dinitrophenoxy)methyl]-5-methoxy-1,2-dimethylindole-4,7-dione Traditional Name: 3-[(2,4-dinitrophenoxy)methyl]-5-methoxy-1,2-dimethyl-indole-4,7-quinone Formula: C18H15N3O8 MolecularWeight: 401.327

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C(=O)C=C(C2=O)OC)COC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N1C)C(=O)C=C(C2=O)OC)COC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O8/c1-9-11(16-17(19(9)2)13(22)7-15(28-3)18(16)23)8-29-14-5-4-10(20(24)25)6-12(14)21(26)27/h4-7H,8H2,1-3H3