3-[(4-chloranyl-3-methoxy-phenyl)methyl]-5-oxidanyl-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(4-chloranyl-3-methoxy-phenyl)methyl]-5-oxidanyl-1H-indole-2-carboxylic acid Openeye Name: 3-[(4-chloro-3-methoxy-phenyl)methyl]-5-hydroxy-1H-indole-2-carboxylic acid CAS Name: 3-[(4-chloro-3-methoxyphenyl)methyl]-5-hydroxy-1H-indole-2-carboxylic acid IUPAC Name: 3-[(4-chloro-3-methoxyphenyl)methyl]-5-hydroxy-1H-indole-2-carboxylic acid Traditional Name: 3-(4-chloro-3-methoxy-benzyl)-5-hydroxy-1H-indole-2-carboxylic acid Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=C(NC3=C2C=C(C=C3)O)C(=O)O)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(NC3=C2C=C(C=C3)O)C(=O)O)Cl

InChI

InChI=1S/C17H14ClNO4/c1-23-15-7-9(2-4-13(15)18)6-12-11-8-10(20)3-5-14(11)19-16(12)17(21)22/h2-5,7-8,19-20H,6H2,1H3,(H,21,22)