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

Systemtic Name: 3-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2-carboxylic acid CAS Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1H-indole-2-carboxylic acid Formula: C17H12ClNO4 MolecularWeight: 329.73448

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CC3=C(NC4=CC=CC=C43)C(=O)O)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CC3=C(NC4=CC=CC=C43)C(=O)O)Cl

InChI

InChI=1S/C17H12ClNO4/c18-12-7-15-14(22-8-23-15)6-9(12)5-11-10-3-1-2-4-13(10)19-16(11)17(20)21/h1-4,6-7,19H,5,8H2,(H,20,21)