3-(2-carboxycyclopropyl)-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-(2-carboxycyclopropyl)-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylic acid Openeye Name: 3-(2-carboxycyclopropyl)-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylic acid CAS Name: 3-(2-carboxycyclopropyl)-1-[(3,4-dichlorophenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-(2-carboxycyclopropyl)-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylic acid Traditional Name: 3-(2-carboxycyclopropyl)-1-(3,4-dichlorobenzyl)indole-2-carboxylic acid Formula: C20H15Cl2NO4 MolecularWeight: 404.2434

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(=O)O)C2=C(N(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

C1C(C1C(=O)O)C2=C(N(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

InChI

InChI=1S/C20H15Cl2NO4/c21-14-6-5-10(7-15(14)22)9-23-16-4-2-1-3-11(16)17(18(23)20(26)27)12-8-13(12)19(24)25/h1-7,12-13H,8-9H2,(H,24,25)(H,26,27)