5-chloranyl-2-hexadecoxy-N-[(4-nitrophenyl)methylideneamino]aniline

Systemtic Name: 5-chloranyl-2-hexadecoxy-N-[(4-nitrophenyl)methylideneamino]aniline Openeye Name: 5-chloro-2-hexadecoxy-N-[(4-nitrophenyl)methyleneamino]aniline CAS Name: 5-chloro-2-hexadecoxy-N-[(4-nitrophenyl)methylideneamino]aniline IUPAC Name: 5-chloro-2-hexadecoxy-N-[(4-nitrophenyl)methylideneamino]aniline Traditional Name: (2-cetyloxy-5-chloro-phenyl)-[(4-nitrobenzylidene)amino]amine Formula: C29H42ClN3O3 MolecularWeight: 516.11508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)Cl)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)Cl)NN=CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C29H42ClN3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-36-29-21-18-26(30)23-28(29)32-31-24-25-16-19-27(20-17-25)33(34)35/h16-21,23-24,32H,2-15,22H2,1H3