N-cycloheptyl-6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-cycloheptyl-6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-cycloheptyl-6-(1-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-cycloheptyl-6-(1-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-cycloheptyl-6-naphthalen-1-yloxy-5-nitropyrimidin-4-amine Traditional Name: cycloheptyl-[6-(1-naphthoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C(C(=NC=N2)OC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC2=C(C(=NC=N2)OC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3/c26-25(27)19-20(24-16-10-3-1-2-4-11-16)22-14-23-21(19)28-18-13-7-9-15-8-5-6-12-17(15)18/h5-9,12-14,16H,1-4,10-11H2,(H,22,23,24)