2-chloranyl-4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-6-methyl-5-nitro-pyrimidine

Systemtic Name: 2-chloranyl-4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-6-methyl-5-nitro-pyrimidine Openeye Name: 2-chloro-4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-6-methyl-5-nitro-pyrimidine CAS Name: 2-chloro-4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-6-methyl-5-nitropyrimidine IUPAC Name: 2-chloro-4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-6-methyl-5-nitropyrimidine Traditional Name: 2-chloro-4-[3-(cyclopentoxy)-4-methoxy-benzyl]-6-methyl-5-nitro-pyrimidine Formula: C18H20ClN3O4 MolecularWeight: 377.8221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)Cl)CC2=CC(=C(C=C2)OC)OC3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)Cl)CC2=CC(=C(C=C2)OC)OC3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN3O4/c1-11-17(22(23)24)14(21-18(19)20-11)9-12-7-8-15(25-2)16(10-12)26-13-5-3-4-6-13/h7-8,10,13H,3-6,9H2,1-2H3