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4-[(3-chloranyl-4-hexadecoxy-phenyl)iminomethyl]benzoic acid

4-[(3-chloranyl-4-hexadecoxy-phenyl)iminomethyl]benzoic acid

Systemtic Name:4-[(3-chloranyl-4-hexadecoxy-phenyl)iminomethyl]benzoic acid
Openeye Name:4-[(3-chloro-4-hexadecoxy-phenyl)iminomethyl]benzoic acid
CAS Name:4-[(3-chloro-4-hexadecoxyphenyl)iminomethyl]benzoic acid
IUPAC Name:4-[(3-chloro-4-hexadecoxyphenyl)iminomethyl]benzoic acid
Traditional Name:4-[(4-cetyloxy-3-chloro-phenyl)iminomethyl]benzoic acid
Formula: C30H42ClNO3
MolecularWeight: 500.11238
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)N=CC2=CC=C(C=C2)C(=O)O)Cl


Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)N=CC2=CC=C(C=C2)C(=O)O)Cl


InChI

InChI=1S/C30H42ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-35-29-21-20-27(23-28(29)31)32-24-25-16-18-26(19-17-25)30(33)34/h16-21,23-24H,2-15,22H2,1H3,(H,33,34)


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