6-azanyl-2,2-dimethyl-7-nitro-4-(pentylamino)-3,4-dihydrochromen-3-ol

Systemtic Name: 6-azanyl-2,2-dimethyl-7-nitro-4-(pentylamino)-3,4-dihydrochromen-3-ol Openeye Name: 6-amino-2,2-dimethyl-7-nitro-4-(pentylamino)chroman-3-ol CAS Name: 6-amino-2,2-dimethyl-7-nitro-4-(pentylamino)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 6-amino-2,2-dimethyl-7-nitro-4-(pentylamino)-3,4-dihydrochromen-3-ol Traditional Name: 6-amino-4-(amylamino)-2,2-dimethyl-7-nitro-chroman-3-ol Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1C(C(OC2=CC(=C(C=C12)N)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CCCCCNC1C(C(OC2=CC(=C(C=C12)N)[N+](=O)[O-])(C)C)O

InChI

InChI=1S/C16H25N3O4/c1-4-5-6-7-18-14-10-8-11(17)12(19(21)22)9-13(10)23-16(2,3)15(14)20/h8-9,14-15,18,20H,4-7,17H2,1-3H3