N-butyl-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-butyl-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-butyl-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-butyl-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-4-pyrimidinamine IUPAC Name: N-butyl-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: butyl-[6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-yl]amine Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC3=CC=CC=C32

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCCC3=CC=CC=C32

InChI

InChI=1S/C17H21N5O2/c1-2-3-10-18-16-15(22(23)24)17(20-12-19-16)21-11-6-8-13-7-4-5-9-14(13)21/h4-5,7,9,12H,2-3,6,8,10-11H2,1H3,(H,18,19,20)