4,6-bis(chloranyl)-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-indole-2-carboxylic acid Formula: C21H18Cl2N2O2 MolecularWeight: 401.28582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)CC3=C(NC4=CC(=CC(=C43)Cl)Cl)C(=O)O

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)CC3=C(NC4=CC(=CC(=C43)Cl)Cl)C(=O)O

InChI

InChI=1S/C21H18Cl2N2O2/c22-15-10-17(23)19-16(20(21(26)27)24-18(19)11-15)12-25-8-6-14(7-9-25)13-4-2-1-3-5-13/h1-6,10-11,24H,7-9,12H2,(H,26,27)