4-[5-chloranyl-1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-benzoic acid

Systemtic Name: 4-[5-chloranyl-1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-benzoic acid Openeye Name: 4-(5-chloro-1,3-dioxo-isoindolin-2-yl)-3-methyl-benzoic acid CAS Name: 4-(5-chloro-1,3-dioxo-2-isoindolyl)-3-methylbenzoic acid IUPAC Name: 4-(5-chloro-1,3-dioxoisoindol-2-yl)-3-methylbenzoic acid Traditional Name: 4-(5-chloro-1,3-diketo-isoindolin-2-yl)-3-methyl-benzoic acid Formula: C16H10ClNO4 MolecularWeight: 315.7079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C16H10ClNO4/c1-8-6-9(16(21)22)2-5-13(8)18-14(19)11-4-3-10(17)7-12(11)15(18)20/h2-7H,1H3,(H,21,22)