N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[2-(3,4-dimethoxyphenyl)ethyl]-N4-(2-methoxyethyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-(2-methoxyethyl)-5-nitropyrimidine-4,6-diamine Traditional Name: homoveratryl-[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H23N5O5 MolecularWeight: 377.39502

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

COCCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H23N5O5/c1-25-9-8-19-17-15(22(23)24)16(20-11-21-17)18-7-6-12-4-5-13(26-2)14(10-12)27-3/h4-5,10-11H,6-9H2,1-3H3,(H2,18,19,20,21)