5-bromanyl-2-chloranyl-N-[4-(3-nitrophenoxy)butyl]pyrimidin-4-amine

Systemtic Name: 5-bromanyl-2-chloranyl-N-[4-(3-nitrophenoxy)butyl]pyrimidin-4-amine Openeye Name: 5-bromo-2-chloro-N-[4-(3-nitrophenoxy)butyl]pyrimidin-4-amine CAS Name: 5-bromo-2-chloro-N-[4-(3-nitrophenoxy)butyl]-4-pyrimidinamine IUPAC Name: 5-bromo-2-chloro-N-[4-(3-nitrophenoxy)butyl]pyrimidin-4-amine Traditional Name: (5-bromo-2-chloro-pyrimidin-4-yl)-[4-(3-nitrophenoxy)butyl]amine Formula: C14H14BrClN4O3 MolecularWeight: 401.64296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCNC2=NC(=NC=C2Br)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCNC2=NC(=NC=C2Br)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H14BrClN4O3/c15-12-9-18-14(16)19-13(12)17-6-1-2-7-23-11-5-3-4-10(8-11)20(21)22/h3-5,8-9H,1-2,6-7H2,(H,17,18,19)