3-[(3,4-dichlorophenyl)methyl]-1H-indole-2,5-dicarboxylic acid

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-1H-indole-2,5-dicarboxylic acid Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-1H-indole-2,5-dicarboxylic acid CAS Name: 3-[(3,4-dichlorophenyl)methyl]-1H-indole-2,5-dicarboxylic acid IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-1H-indole-2,5-dicarboxylic acid Traditional Name: 3-(3,4-dichlorobenzyl)-1H-indole-2,5-dicarboxylic acid Formula: C17H11Cl2NO4 MolecularWeight: 364.17954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=C(NC3=C2C=C(C=C3)C(=O)O)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CC2=C(NC3=C2C=C(C=C3)C(=O)O)C(=O)O)Cl)Cl

InChI

InChI=1S/C17H11Cl2NO4/c18-12-3-1-8(6-13(12)19)5-11-10-7-9(16(21)22)2-4-14(10)20-15(11)17(23)24/h1-4,6-7,20H,5H2,(H,21,22)(H,23,24)