aminocarbonyl-[4-(2-aminocarbonylphenyl)but-3-yn-2-yl]carbamic acid

Systemtic Name: aminocarbonyl-[4-(2-aminocarbonylphenyl)but-3-yn-2-yl]carbamic acid Openeye Name: carbamoyl-[3-(2-carbamoylphenyl)-1-methyl-prop-2-ynyl]carbamic acid CAS Name: carbamoyl-[4-(2-carbamoylphenyl)but-3-yn-2-yl]carbamic acid IUPAC Name: carbamoyl-[4-(2-carbamoylphenyl)but-3-yn-2-yl]carbamic acid Traditional Name: carbamoyl-[3-(2-carbamoylphenyl)-1-methyl-prop-2-ynyl]carbamic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=CC=C1C(=O)N)N(C(=O)N)C(=O)O

Isomeric SMILES

CC(C#CC1=CC=CC=C1C(=O)N)N(C(=O)N)C(=O)O

InChI

InChI=1S/C13H13N3O4/c1-8(16(12(15)18)13(19)20)6-7-9-4-2-3-5-10(9)11(14)17/h2-5,8H,1H3,(H2,14,17)(H2,15,18)(H,19,20)