2-[4-(2-chloranyl-4-nitro-phenoxy)piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-(2-chloranyl-4-nitro-phenoxy)piperidin-1-yl]pyrimidine Openeye Name: 2-[4-(2-chloro-4-nitro-phenoxy)-1-piperidyl]pyrimidine CAS Name: 2-[4-(2-chloro-4-nitrophenoxy)-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-(2-chloro-4-nitrophenoxy)piperidin-1-yl]pyrimidine Traditional Name: 2-[4-(2-chloro-4-nitro-phenoxy)piperidino]pyrimidine Formula: C15H15ClN4O3 MolecularWeight: 334.7576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCC1OC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=NC=CC=N3

InChI

InChI=1S/C15H15ClN4O3/c16-13-10-11(20(21)22)2-3-14(13)23-12-4-8-19(9-5-12)15-17-6-1-7-18-15/h1-3,6-7,10,12H,4-5,8-9H2