N-[3-methoxy-4-(2-oxidanylidenechromen-3-yl)phenyl]-2,4-dinitro-benzamide

Systemtic Name: N-[3-methoxy-4-(2-oxidanylidenechromen-3-yl)phenyl]-2,4-dinitro-benzamide Openeye Name: N-[3-methoxy-4-(2-oxochromen-3-yl)phenyl]-2,4-dinitro-benzamide CAS Name: N-[3-methoxy-4-(2-oxo-1-benzopyran-3-yl)phenyl]-2,4-dinitrobenzamide IUPAC Name: N-[3-methoxy-4-(2-oxochromen-3-yl)phenyl]-2,4-dinitrobenzamide Traditional Name: N-[4-(2-ketochromen-3-yl)-3-methoxy-phenyl]-2,4-dinitro-benzamide Formula: C23H15N3O8 MolecularWeight: 461.3805

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H15N3O8/c1-33-21-11-14(24-22(27)17-9-7-15(25(29)30)12-19(17)26(31)32)6-8-16(21)18-10-13-4-2-3-5-20(13)34-23(18)28/h2-12H,1H3,(H,24,27)