(3Z)-6-nitro-3-[1-(pentylamino)ethylidene]chromene-2,4-dione

Systemtic Name: (3Z)-6-nitro-3-[1-(pentylamino)ethylidene]chromene-2,4-dione Openeye Name: (3Z)-6-nitro-3-[1-(pentylamino)ethylidene]chromane-2,4-dione CAS Name: (3Z)-6-nitro-3-[1-(pentylamino)ethylidene]-3,4-dihydro-2H-1-benzopyran-2,4-dione IUPAC Name: (3Z)-6-nitro-3-[1-(pentylamino)ethylidene]chromene-2,4-dione Traditional Name: (3Z)-3-[1-(amylamino)ethylidene]-6-nitro-chroman-2,4-quinone Formula: C16H18N2O5 MolecularWeight: 318.32452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=C1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC1=O)C

Isomeric SMILES

CCCCCN/C(=C\1/C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC1=O)/C

InChI

InChI=1S/C16H18N2O5/c1-3-4-5-8-17-10(2)14-15(19)12-9-11(18(21)22)6-7-13(12)23-16(14)20/h6-7,9,17H,3-5,8H2,1-2H3/b14-10-