2-chloranyl-1-[(4-hydroxyphenyl)methyl]-6-methyl-5-oxidanyl-indole-3-carboxylic acid

Systemtic Name: 2-chloranyl-1-[(4-hydroxyphenyl)methyl]-6-methyl-5-oxidanyl-indole-3-carboxylic acid Openeye Name: 2-chloro-5-hydroxy-1-[(4-hydroxyphenyl)methyl]-6-methyl-indole-3-carboxylic acid CAS Name: 2-chloro-5-hydroxy-1-[(4-hydroxyphenyl)methyl]-6-methyl-3-indolecarboxylic acid IUPAC Name: 2-chloro-5-hydroxy-1-[(4-hydroxyphenyl)methyl]-6-methylindole-3-carboxylic acid Traditional Name: 2-chloro-5-hydroxy-1-(4-hydroxybenzyl)-6-methyl-indole-3-carboxylic acid Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)N(C(=C2C(=O)O)Cl)CC3=CC=C(C=C3)O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)N(C(=C2C(=O)O)Cl)CC3=CC=C(C=C3)O)O

InChI

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