N-[2-(3,4-dimethoxyphenyl)ethyl]-1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-nitro-9,10-dioxo-anthracene-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-nitro-9,10-dioxo-2-anthracenecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-nitro-9,10-dioxoanthracene-2-carboxamide Traditional Name: N-homoveratryl-9,10-diketo-1-nitro-anthracene-2-carboxamide Formula: C25H20N2O7 MolecularWeight: 460.4355

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-])OC

InChI

InChI=1S/C25H20N2O7/c1-33-19-10-7-14(13-20(19)34-2)11-12-26-25(30)18-9-8-17-21(22(18)27(31)32)24(29)16-6-4-3-5-15(16)23(17)28/h3-10,13H,11-12H2,1-2H3,(H,26,30)