2-(3-chlorophenyl)-3-(2-hydroxyethylamino)-1-propyl-indole-6-carboxylic acid

Systemtic Name: 2-(3-chlorophenyl)-3-(2-hydroxyethylamino)-1-propyl-indole-6-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-3-(2-hydroxyethylamino)-1-propyl-indole-6-carboxylic acid CAS Name: 2-(3-chlorophenyl)-3-(2-hydroxyethylamino)-1-propyl-6-indolecarboxylic acid IUPAC Name: 2-(3-chlorophenyl)-3-(2-hydroxyethylamino)-1-propylindole-6-carboxylic acid Traditional Name: 2-(3-chlorophenyl)-3-(2-hydroxyethylamino)-1-propyl-indole-6-carboxylic acid Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CC(=CC=C3)Cl)NCCO

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CC(=CC=C3)Cl)NCCO

InChI

InChI=1S/C20H21ClN2O3/c1-2-9-23-17-12-14(20(25)26)6-7-16(17)18(22-8-10-24)19(23)13-4-3-5-15(21)11-13/h3-7,11-12,22,24H,2,8-10H2,1H3,(H,25,26)