5-bromanyl-2-butan-2-yl-8-nitro-3,4-dihydro-1H-isoquinoline

Systemtic Name: 5-bromanyl-2-butan-2-yl-8-nitro-3,4-dihydro-1H-isoquinoline Openeye Name: 5-bromo-8-nitro-2-sec-butyl-3,4-dihydro-1H-isoquinoline CAS Name: 5-bromo-2-butan-2-yl-8-nitro-3,4-dihydro-1H-isoquinoline IUPAC Name: 5-bromo-2-butan-2-yl-8-nitro-3,4-dihydro-1H-isoquinoline Traditional Name: 5-bromo-8-nitro-2-sec-butyl-3,4-dihydro-1H-isoquinoline Formula: C13H17BrN2O2 MolecularWeight: 313.19028

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCC2=C(C=CC(=C2C1)[N+](=O)[O-])Br

Isomeric SMILES

CCC(C)N1CCC2=C(C=CC(=C2C1)[N+](=O)[O-])Br

InChI

InChI=1S/C13H17BrN2O2/c1-3-9(2)15-7-6-10-11(8-15)13(16(17)18)5-4-12(10)14/h4-5,9H,3,6-8H2,1-2H3