methyl 3-chloranyl-4,6-bis(oxidanyl)-2-(5-oxidanylidene-5-phenylazanyl-pentyl)benzoate

Systemtic Name: methyl 3-chloranyl-4,6-bis(oxidanyl)-2-(5-oxidanylidene-5-phenylazanyl-pentyl)benzoate Openeye Name: methyl 2-(5-anilino-5-oxo-pentyl)-3-chloro-4,6-dihydroxy-benzoate CAS Name: 2-(5-anilino-5-oxopentyl)-3-chloro-4,6-dihydroxybenzoic acid methyl ester IUPAC Name: methyl 2-(5-anilino-5-oxopentyl)-3-chloro-4,6-dihydroxybenzoate Traditional Name: 2-(5-anilino-5-keto-pentyl)-3-chloro-4,6-dihydroxy-benzoic acid methyl ester Formula: C19H20ClNO5 MolecularWeight: 377.8188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1O)O)Cl)CCCCC(=O)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1O)O)Cl)CCCCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H20ClNO5/c1-26-19(25)17-13(18(20)15(23)11-14(17)22)9-5-6-10-16(24)21-12-7-3-2-4-8-12/h2-4,7-8,11,22-23H,5-6,9-10H2,1H3,(H,21,24)