5-nitro-4-(4-propan-2-ylphenoxy)-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 5-nitro-4-(4-propan-2-ylphenoxy)-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-(4-isopropylphenoxy)-5-nitro-6-pyrrolidin-1-yl-pyrimidine CAS Name: 5-nitro-4-(4-propan-2-ylphenoxy)-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 5-nitro-4-(4-propan-2-ylphenoxy)-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-(4-isopropylphenoxy)-5-nitro-6-pyrrolidino-pyrimidine Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C17H20N4O3/c1-12(2)13-5-7-14(8-6-13)24-17-15(21(22)23)16(18-11-19-17)20-9-3-4-10-20/h5-8,11-12H,3-4,9-10H2,1-2H3