3-[4-[5-[bis(chloranyl)methyl]pyridin-3-yl]oxy-2-nitro-phenyl]-1-butyl-1-propyl-urea

Systemtic Name: 3-[4-[5-[bis(chloranyl)methyl]pyridin-3-yl]oxy-2-nitro-phenyl]-1-butyl-1-propyl-urea Openeye Name: 1-butyl-3-[4-[[5-(dichloromethyl)-3-pyridyl]oxy]-2-nitro-phenyl]-1-propyl-urea CAS Name: 1-butyl-3-[4-[[5-(dichloromethyl)-3-pyridinyl]oxy]-2-nitrophenyl]-1-propylurea IUPAC Name: 1-butyl-3-[4-[5-(dichloromethyl)pyridin-3-yl]oxy-2-nitrophenyl]-1-propylurea Traditional Name: 1-butyl-3-[4-[[5-(dichloromethyl)-3-pyridyl]oxy]-2-nitro-phenyl]-1-propyl-urea Formula: C20H24Cl2N4O4 MolecularWeight: 455.33496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC)C(=O)NC1=C(C=C(C=C1)OC2=CN=CC(=C2)C(Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCC)C(=O)NC1=C(C=C(C=C1)OC2=CN=CC(=C2)C(Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H24Cl2N4O4/c1-3-5-9-25(8-4-2)20(27)24-17-7-6-15(11-18(17)26(28)29)30-16-10-14(19(21)22)12-23-13-16/h6-7,10-13,19H,3-5,8-9H2,1-2H3,(H,24,27)