N-cycloheptyl-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-cycloheptyl-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-cycloheptyl-6-(2-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-cycloheptyl-6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-cycloheptyl-6-naphthalen-2-yloxy-5-nitropyrimidin-4-amine Traditional Name: cycloheptyl-[6-(2-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=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

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