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

Systemtic Name: [4-chloranyl-2-[[3-oxidanylidene-3-(3-pyridin-3-ylphenyl)propanoyl]amino]phenyl]carbamic acid Openeye Name: [4-chloro-2-[[3-oxo-3-[3-(3-pyridyl)phenyl]propanoyl]amino]phenyl]carbamic acid CAS Name: [4-chloro-2-[[1,3-dioxo-3-[3-(3-pyridinyl)phenyl]propyl]amino]phenyl]carbamic acid IUPAC Name: [4-chloro-2-[[3-oxo-3-(3-pyridin-3-ylphenyl)propanoyl]amino]phenyl]carbamic acid Traditional Name: [4-chloro-2-[[3-keto-3-[3-(3-pyridyl)phenyl]propanoyl]amino]phenyl]carbamic acid Formula: C21H16ClN3O4 MolecularWeight: 409.82244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)Cl)NC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)Cl)NC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C21H16ClN3O4/c22-16-6-7-17(25-21(28)29)18(10-16)24-20(27)11-19(26)14-4-1-3-13(9-14)15-5-2-8-23-12-15/h1-10,12,25H,11H2,(H,24,27)(H,28,29)