1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-oxidanyl-indole-2-carboxylic acid

Systemtic Name: 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-oxidanyl-indole-2-carboxylic acid Openeye Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxy-indole-2-carboxylic acid CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxy-2-indolecarboxylic acid IUPAC Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxyindole-2-carboxylic acid Traditional Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-hydroxy-indole-2-carboxylic acid Formula: C17H12ClNO5 MolecularWeight: 345.73388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CN3C4=C(C=C(C=C4)O)C=C3C(=O)O)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CN3C4=C(C=C(C=C4)O)C=C3C(=O)O)Cl

InChI

InChI=1S/C17H12ClNO5/c18-12-6-16-15(23-8-24-16)5-10(12)7-19-13-2-1-11(20)3-9(13)4-14(19)17(21)22/h1-6,20H,7-8H2,(H,21,22)