1-(6-but-3-enoxy-5-cyano-pyrazin-2-yl)-3-(5-chloranyl-4-nitro-2-prop-2-enoxy-phenyl)urea

Systemtic Name: 1-(6-but-3-enoxy-5-cyano-pyrazin-2-yl)-3-(5-chloranyl-4-nitro-2-prop-2-enoxy-phenyl)urea Openeye Name: 1-(2-allyloxy-5-chloro-4-nitro-phenyl)-3-(6-but-3-enoxy-5-cyano-pyrazin-2-yl)urea CAS Name: 1-(6-but-3-enoxy-5-cyano-2-pyrazinyl)-3-(5-chloro-4-nitro-2-prop-2-enoxyphenyl)urea IUPAC Name: 1-(6-but-3-enoxy-5-cyanopyrazin-2-yl)-3-(5-chloro-4-nitro-2-prop-2-enoxyphenyl)urea Traditional Name: 1-(2-allyloxy-5-chloro-4-nitro-phenyl)-3-(6-but-3-enoxy-5-cyano-pyrazin-2-yl)urea Formula: C19H17ClN6O5 MolecularWeight: 444.82848

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCOC1=NC(=CN=C1C#N)NC(=O)NC2=CC(=C(C=C2OCC=C)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCCOC1=NC(=CN=C1C#N)NC(=O)NC2=CC(=C(C=C2OCC=C)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H17ClN6O5/c1-3-5-7-31-18-14(10-21)22-11-17(24-18)25-19(27)23-13-8-12(20)15(26(28)29)9-16(13)30-6-4-2/h3-4,8-9,11H,1-2,5-7H2,(H2,23,24,25,27)