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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-pyridin-3-yl-indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-(3-pyridyl)indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-(3-pyridinyl)-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-pyridin-3-ylindole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-4-(3-pyridyl)indole-2-carboxylic acid Formula: C21H14Cl2N2O2 MolecularWeight: 397.25406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(N(C2=C1)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)C4=CN=CC=C4

Isomeric SMILES

C1=CC(=C2C=C(N(C2=C1)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)C4=CN=CC=C4

InChI

InChI=1S/C21H14Cl2N2O2/c22-17-7-6-13(9-18(17)23)12-25-19-5-1-4-15(14-3-2-8-24-11-14)16(19)10-20(25)21(26)27/h1-11H,12H2,(H,26,27)