2-(carboxycarbonylamino)-6-(naphthalen-2-ylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid

Systemtic Name: 2-(carboxycarbonylamino)-6-(naphthalen-2-ylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Openeye Name: 6-(2-naphthylmethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid CAS Name: 6-(2-naphthalenylmethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid IUPAC Name: 6-(naphthalen-2-ylmethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Traditional Name: 6-(2-naphthylmethyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18N2O5S/c24-18(21(27)28)22-19-17(20(25)26)15-7-8-23(11-16(15)29-19)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-6,9H,7-8,10-11H2,(H,22,24)(H,25,26)(H,27,28)