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

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

Systemtic Name:5-(carboxymethylamino)-3-[(3,4-dichlorophenyl)methyl]-1H-indole-2-carboxylic acid
Openeye Name:5-(carboxymethylamino)-3-[(3,4-dichlorophenyl)methyl]-1H-indole-2-carboxylic acid
CAS Name:5-(carboxymethylamino)-3-[(3,4-dichlorophenyl)methyl]-1H-indole-2-carboxylic acid
IUPAC Name:5-(carboxymethylamino)-3-[(3,4-dichlorophenyl)methyl]-1H-indole-2-carboxylic acid
Traditional Name:5-(carboxymethylamino)-3-(3,4-dichlorobenzyl)-1H-indole-2-carboxylic acid
Formula: C18H14Cl2N2O4
MolecularWeight: 393.22076
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C18H14Cl2N2O4/c19-13-3-1-9(6-14(13)20)5-12-11-7-10(21-8-16(23)24)2-4-15(11)22-17(12)18(25)26/h1-4,6-7,21-22H,5,8H2,(H,23,24)(H,25,26)


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