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

Systemtic Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodanyl-5-methoxy-phenyl]methylideneamino]-4-nitro-aniline Openeye Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxy-phenyl]methyleneamino]-4-nitro-aniline CAS Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxyphenyl]methylideneamino]-4-nitroaniline IUPAC Name: N-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxyphenyl]methylideneamino]-4-nitroaniline Traditional Name: [(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-iodo-5-methoxy-benzylidene]amino]-(4-nitrophenyl)amine Formula: C28H32IN3O6 MolecularWeight: 633.47465

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2I)C=NNC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2I)/C=N/NC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C28H32IN3O6/c1-3-4-5-6-15-36-24-11-13-25(14-12-24)37-16-17-38-28-26(29)18-21(19-27(28)35-2)20-30-31-22-7-9-23(10-8-22)32(33)34/h7-14,18-20,31H,3-6,15-17H2,1-2H3/b30-20+