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

Systemtic Name: 4-[(3-chloranyl-4-heptoxy-phenyl)iminomethyl]benzoic acid Openeye Name: 4-[(3-chloro-4-heptoxy-phenyl)iminomethyl]benzoic acid CAS Name: 4-[(3-chloro-4-heptoxyphenyl)iminomethyl]benzoic acid IUPAC Name: 4-[(3-chloro-4-heptoxyphenyl)iminomethyl]benzoic acid Traditional Name: 4-[(3-chloro-4-heptoxy-phenyl)iminomethyl]benzoic acid Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)N=CC2=CC=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)N=CC2=CC=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C21H24ClNO3/c1-2-3-4-5-6-13-26-20-12-11-18(14-19(20)22)23-15-16-7-9-17(10-8-16)21(24)25/h7-12,14-15H,2-6,13H2,1H3,(H,24,25)