3-(carboxymethyl)-2-methyl-1-(phenylmethyl)indole-5-carboxylic acid

Systemtic Name: 3-(carboxymethyl)-2-methyl-1-(phenylmethyl)indole-5-carboxylic acid Openeye Name: 1-benzyl-3-(carboxymethyl)-2-methyl-indole-5-carboxylic acid CAS Name: 3-(carboxymethyl)-2-methyl-1-(phenylmethyl)-5-indolecarboxylic acid IUPAC Name: 1-benzyl-3-(carboxymethyl)-2-methylindole-5-carboxylic acid Traditional Name: 1-benzyl-3-(carboxymethyl)-2-methyl-indole-5-carboxylic acid Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(=O)O)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(=O)O)CC(=O)O

InChI

InChI=1S/C19H17NO4/c1-12-15(10-18(21)22)16-9-14(19(23)24)7-8-17(16)20(12)11-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,21,22)(H,23,24)