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

Systemtic Name: 1-[(E)-[3-bromanyl-4-[2-(4-hexylphenoxy)ethoxy]-5-methoxy-phenyl]methylideneamino]urea Openeye Name: [(E)-[3-bromo-4-[2-(4-hexylphenoxy)ethoxy]-5-methoxy-phenyl]methyleneamino]urea CAS Name: [(E)-[3-bromo-4-[2-(4-hexylphenoxy)ethoxy]-5-methoxyphenyl]methylideneamino]urea IUPAC Name: [(E)-[3-bromo-4-[2-(4-hexylphenoxy)ethoxy]-5-methoxyphenyl]methylideneamino]urea Traditional Name: [(E)-[3-bromo-4-[2-(4-hexylphenoxy)ethoxy]-5-methoxy-benzylidene]amino]urea Formula: C23H30BrN3O4 MolecularWeight: 492.406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Br)C=NNC(=O)N)OC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Br)/C=N/NC(=O)N)OC

InChI

InChI=1S/C23H30BrN3O4/c1-3-4-5-6-7-17-8-10-19(11-9-17)30-12-13-31-22-20(24)14-18(15-21(22)29-2)16-26-27-23(25)28/h8-11,14-16H,3-7,12-13H2,1-2H3,(H3,25,27,28)/b26-16+