6-azanyl-7-nitro-4-(pentylamino)-3,4-dihydro-2H-chromen-3-ol

Systemtic Name: 6-azanyl-7-nitro-4-(pentylamino)-3,4-dihydro-2H-chromen-3-ol Openeye Name: 6-amino-7-nitro-4-(pentylamino)chroman-3-ol CAS Name: 6-amino-7-nitro-4-(pentylamino)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 6-amino-7-nitro-4-(pentylamino)-3,4-dihydro-2H-chromen-3-ol Traditional Name: 6-amino-4-(amylamino)-7-nitro-chroman-3-ol Formula: C14H21N3O4 MolecularWeight: 295.33424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1C(COC2=CC(=C(C=C12)N)[N+](=O)[O-])O

Isomeric SMILES

CCCCCNC1C(COC2=CC(=C(C=C12)N)[N+](=O)[O-])O

InChI

InChI=1S/C14H21N3O4/c1-2-3-4-5-16-14-9-6-10(15)11(17(19)20)7-13(9)21-8-12(14)18/h6-7,12,14,16,18H,2-5,8,15H2,1H3