[3-ethynyl-2-[[3-oxidanylidene-3-(3-pyridin-3-ylphenyl)propanoyl]amino]phenyl]carbamic acid

Systemtic Name: [3-ethynyl-2-[[3-oxidanylidene-3-(3-pyridin-3-ylphenyl)propanoyl]amino]phenyl]carbamic acid Openeye Name: [3-ethynyl-2-[[3-oxo-3-[3-(3-pyridyl)phenyl]propanoyl]amino]phenyl]carbamic acid CAS Name: [2-[[1,3-dioxo-3-[3-(3-pyridinyl)phenyl]propyl]amino]-3-ethynylphenyl]carbamic acid IUPAC Name: [3-ethynyl-2-[[3-oxo-3-(3-pyridin-3-ylphenyl)propanoyl]amino]phenyl]carbamic acid Traditional Name: [3-ethynyl-2-[[3-keto-3-[3-(3-pyridyl)phenyl]propanoyl]amino]phenyl]carbamic acid Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C(=CC=C1)NC(=O)O)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CN=CC=C3

Isomeric SMILES

C#CC1=C(C(=CC=C1)NC(=O)O)NC(=O)CC(=O)C2=CC=CC(=C2)C3=CN=CC=C3

InChI

InChI=1S/C23H17N3O4/c1-2-15-6-4-10-19(25-23(29)30)22(15)26-21(28)13-20(27)17-8-3-7-16(12-17)18-9-5-11-24-14-18/h1,3-12,14,25H,13H2,(H,26,28)(H,29,30)