1-[(E)-[2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]-5-nitro-phenyl]methylideneamino]urea

Systemtic Name: 1-[(E)-[2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]-5-nitro-phenyl]methylideneamino]urea Openeye Name: [(E)-[2-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]-5-nitro-phenyl]methyleneamino]urea CAS Name: [(E)-[2-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]-5-nitrophenyl]methylideneamino]urea IUPAC Name: [(E)-[2-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]-5-nitrophenyl]methylideneamino]urea Traditional Name: [(E)-[2-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]-5-nitro-benzylidene]amino]urea Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)[N+](=O)[O-])C=NNC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)[N+](=O)[O-])/C=N/NC(=O)N

InChI

InChI=1S/C20H24N4O5/c1-13(2)17-6-4-14(3)10-19(17)29-9-8-28-18-7-5-16(24(26)27)11-15(18)12-22-23-20(21)25/h4-7,10-13H,8-9H2,1-3H3,(H3,21,23,25)/b22-12+