N-[4-chloranyl-6-methyl-5-[3-(4-nitrophenoxy)propyl]pyrimidin-2-yl]ethanamide

Systemtic Name: N-[4-chloranyl-6-methyl-5-[3-(4-nitrophenoxy)propyl]pyrimidin-2-yl]ethanamide Openeye Name: N-[4-chloro-6-methyl-5-[3-(4-nitrophenoxy)propyl]pyrimidin-2-yl]acetamide CAS Name: N-[4-chloro-6-methyl-5-[3-(4-nitrophenoxy)propyl]-2-pyrimidinyl]acetamide IUPAC Name: N-[4-chloro-6-methyl-5-[3-(4-nitrophenoxy)propyl]pyrimidin-2-yl]acetamide Traditional Name: N-[4-chloro-6-methyl-5-[3-(4-nitrophenoxy)propyl]pyrimidin-2-yl]acetamide Formula: C16H17ClN4O4 MolecularWeight: 364.78358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC(=O)C)Cl)CCCOC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NC(=O)C)Cl)CCCOC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN4O4/c1-10-14(15(17)20-16(18-10)19-11(2)22)4-3-9-25-13-7-5-12(6-8-13)21(23)24/h5-8H,3-4,9H2,1-2H3,(H,18,19,20,22)