6-(carboxycarbonylamino)-1-(phenylmethyl)indole-5-carboxylic acid

Systemtic Name: 6-(carboxycarbonylamino)-1-(phenylmethyl)indole-5-carboxylic acid Openeye Name: 1-benzyl-6-(oxaloamino)indole-5-carboxylic acid CAS Name: 6-(oxaloamino)-1-(phenylmethyl)-5-indolecarboxylic acid IUPAC Name: 1-benzyl-6-(oxaloamino)indole-5-carboxylic acid Traditional Name: 1-benzyl-6-(oxaloamino)indole-5-carboxylic acid Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC3=CC(=C(C=C32)NC(=O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC3=CC(=C(C=C32)NC(=O)C(=O)O)C(=O)O

InChI

InChI=1S/C18H14N2O5/c21-16(18(24)25)19-14-9-15-12(8-13(14)17(22)23)6-7-20(15)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,19,21)(H,22,23)(H,24,25)