N-(3-methoxypropyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3-methoxypropyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(3-methoxypropyl)-6-(2-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(3-methoxypropyl)-6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(3-methoxypropyl)-6-naphthalen-2-yloxy-5-nitropyrimidin-4-amine Traditional Name: 3-methoxypropyl-[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C(=NC=N1)OC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCCNC1=C(C(=NC=N1)OC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4/c1-25-10-4-9-19-17-16(22(23)24)18(21-12-20-17)26-15-8-7-13-5-2-3-6-14(13)11-15/h2-3,5-8,11-12H,4,9-10H2,1H3,(H,19,20,21)