1-[(E)-[3-bromanyl-4-[2-(4-hexoxyphenoxy)ethoxy]-5-methoxy-phenyl]methylideneamino]urea

Systemtic Name: 1-[(E)-[3-bromanyl-4-[2-(4-hexoxyphenoxy)ethoxy]-5-methoxy-phenyl]methylideneamino]urea Openeye Name: [(E)-[3-bromo-4-[2-(4-hexoxyphenoxy)ethoxy]-5-methoxy-phenyl]methyleneamino]urea CAS Name: [(E)-[3-bromo-4-[2-(4-hexoxyphenoxy)ethoxy]-5-methoxyphenyl]methylideneamino]urea IUPAC Name: [(E)-[3-bromo-4-[2-(4-hexoxyphenoxy)ethoxy]-5-methoxyphenyl]methylideneamino]urea Traditional Name: [(E)-[3-bromo-4-[2-(4-hexoxyphenoxy)ethoxy]-5-methoxy-benzylidene]amino]urea Formula: C23H30BrN3O5 MolecularWeight: 508.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Br)C=NNC(=O)N)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Br)/C=N/NC(=O)N)OC

InChI

InChI=1S/C23H30BrN3O5/c1-3-4-5-6-11-30-18-7-9-19(10-8-18)31-12-13-32-22-20(24)14-17(15-21(22)29-2)16-26-27-23(25)28/h7-10,14-16H,3-6,11-13H2,1-2H3,(H3,25,27,28)/b26-16+