1-[(3,4-dichlorophenyl)methyl]-5-ethanoyl-indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-5-ethanoyl-indole-2-carboxylic acid Openeye Name: 5-acetyl-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylic acid CAS Name: 5-acetyl-1-[(3,4-dichlorophenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 5-acetyl-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylic acid Traditional Name: 5-acetyl-1-(3,4-dichlorobenzyl)indole-2-carboxylic acid Formula: C18H13Cl2NO3 MolecularWeight: 362.20672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl2NO3/c1-10(22)12-3-5-16-13(7-12)8-17(18(23)24)21(16)9-11-2-4-14(19)15(20)6-11/h2-8H,9H2,1H3,(H,23,24)