5-chloranyl-2-[(2-cyclohexylimino-1-benzofuran-3-ylidene)amino]benzoic acid

Systemtic Name: 5-chloranyl-2-[(2-cyclohexylimino-1-benzofuran-3-ylidene)amino]benzoic acid Openeye Name: 5-chloro-2-[(2-cyclohexyliminobenzofuran-3-ylidene)amino]benzoic acid CAS Name: 5-chloro-2-[(2-cyclohexylimino-3-benzofuranylidene)amino]benzoic acid IUPAC Name: 5-chloro-2-[(2-cyclohexylimino-1-benzofuran-3-ylidene)amino]benzoic acid Traditional Name: 5-chloro-2-[(2-cyclohexyliminocoumaran-3-ylidene)amino]benzoic acid Formula: C21H19ClN2O3 MolecularWeight: 382.84016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2C(=NC3=C(C=C(C=C3)Cl)C(=O)O)C4=CC=CC=C4O2

Isomeric SMILES

C1CCC(CC1)N=C2C(=NC3=C(C=C(C=C3)Cl)C(=O)O)C4=CC=CC=C4O2

InChI

InChI=1S/C21H19ClN2O3/c22-13-10-11-17(16(12-13)21(25)26)24-19-15-8-4-5-9-18(15)27-20(19)23-14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7H2,(H,25,26)