1-[(3,4-dichlorophenyl)methyl]-3-(2-hydroxyethyloxy)-5-methoxy-indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-3-(2-hydroxyethyloxy)-5-methoxy-indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-3-(2-hydroxyethoxy)-5-methoxy-indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-3-(2-hydroxyethoxy)-5-methoxy-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-3-(2-hydroxyethoxy)-5-methoxyindole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-3-(2-hydroxyethoxy)-5-methoxy-indole-2-carboxylic acid Formula: C19H17Cl2NO5 MolecularWeight: 410.24798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=C2OCCO)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=C2OCCO)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H17Cl2NO5/c1-26-12-3-5-16-13(9-12)18(27-7-6-23)17(19(24)25)22(16)10-11-2-4-14(20)15(21)8-11/h2-5,8-9,23H,6-7,10H2,1H3,(H,24,25)