2-(carboxycarbonylamino)-5-[3-(dimethylamino)prop-1-ynyl]benzoic acid

Systemtic Name: 2-(carboxycarbonylamino)-5-[3-(dimethylamino)prop-1-ynyl]benzoic acid Openeye Name: 5-[3-(dimethylamino)prop-1-ynyl]-2-(oxaloamino)benzoic acid CAS Name: 5-[3-(dimethylamino)prop-1-ynyl]-2-(oxaloamino)benzoic acid IUPAC Name: 5-[3-(dimethylamino)prop-1-ynyl]-2-(oxaloamino)benzoic acid Traditional Name: 5-[3-(dimethylamino)prop-1-ynyl]-2-(oxaloamino)benzoic acid Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CC1=CC(=C(C=C1)NC(=O)C(=O)O)C(=O)O

Isomeric SMILES

CN(C)CC#CC1=CC(=C(C=C1)NC(=O)C(=O)O)C(=O)O

InChI

InChI=1S/C14H14N2O5/c1-16(2)7-3-4-9-5-6-11(10(8-9)13(18)19)15-12(17)14(20)21/h5-6,8H,7H2,1-2H3,(H,15,17)(H,18,19)(H,20,21)