5-chloranyl-3-(4-methoxyphenyl)-2H-isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-3-(4-methoxyphenyl)-2H-isoindole-1-carboxylic acid Openeye Name: 5-chloro-3-(4-methoxyphenyl)-2H-isoindole-1-carboxylic acid CAS Name: 5-chloro-3-(4-methoxyphenyl)-2H-isoindole-1-carboxylic acid IUPAC Name: 5-chloro-3-(4-methoxyphenyl)-2H-isoindole-1-carboxylic acid Traditional Name: 5-chloro-3-(4-methoxyphenyl)-2H-isoindole-1-carboxylic acid Formula: C16H12ClNO3 MolecularWeight: 301.72438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C=C(C=CC3=C(N2)C(=O)O)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C=C(C=CC3=C(N2)C(=O)O)Cl

InChI

InChI=1S/C16H12ClNO3/c1-21-11-5-2-9(3-6-11)14-13-8-10(17)4-7-12(13)15(18-14)16(19)20/h2-8,18H,1H3,(H,19,20)