N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodanyl-5-methoxy-phenyl]methylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodanyl-5-methoxy-phenyl]methylideneamino]pyridine-4-carboxamide Openeye Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxy-phenyl]methyleneamino]pyridine-4-carboxamide CAS Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxyphenyl]methylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxyphenyl]methylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxy-benzylidene]amino]isonicotinamide Formula: C28H32IN3O5 MolecularWeight: 617.47525

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2I)C=NNC(=O)C3=CC=NC=C3)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2I)/C=N/NC(=O)C3=CC=NC=C3)OC

InChI

InChI=1S/C28H32IN3O5/c1-3-4-5-6-15-35-23-7-9-24(10-8-23)36-16-17-37-27-25(29)18-21(19-26(27)34-2)20-31-32-28(33)22-11-13-30-14-12-22/h7-14,18-20H,3-6,15-17H2,1-2H3,(H,32,33)/b31-20+