N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxidanylidene-7-propoxy-chromene-3-carboxamide

Systemtic Name: N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxidanylidene-7-propoxy-chromene-3-carboxamide Openeye Name: N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-7-propoxy-chromene-3-carboxamide CAS Name: N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-7-propoxy-1-benzopyran-3-carboxamide IUPAC Name: N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-7-propoxychromene-3-carboxamide Traditional Name: 2-keto-N-(6-nitro-1,3-benzodioxol-5-yl)-7-propoxy-chromene-3-carboxamide Formula: C20H16N2O8 MolecularWeight: 412.34964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C20H16N2O8/c1-2-5-27-12-4-3-11-6-13(20(24)30-16(11)7-12)19(23)21-14-8-17-18(29-10-28-17)9-15(14)22(25)26/h3-4,6-9H,2,5,10H2,1H3,(H,21,23)