(4Z)-2-[(5-chloranyl-2-iodanyl-phenyl)amino]-4-(2-oxidanylidene-1-pyridin-3-yl-pyrrolidin-3-ylidene)butanoic acid

Systemtic Name: (4Z)-2-[(5-chloranyl-2-iodanyl-phenyl)amino]-4-(2-oxidanylidene-1-pyridin-3-yl-pyrrolidin-3-ylidene)butanoic acid Openeye Name: (4Z)-2-(5-chloro-2-iodo-anilino)-4-[2-oxo-1-(3-pyridyl)pyrrolidin-3-ylidene]butanoic acid CAS Name: (4Z)-2-(5-chloro-2-iodoanilino)-4-[2-oxo-1-(3-pyridinyl)-3-pyrrolidinylidene]butanoic acid IUPAC Name: (4Z)-2-(5-chloro-2-iodoanilino)-4-(2-oxo-1-pyridin-3-ylpyrrolidin-3-ylidene)butanoic acid Traditional Name: (4Z)-2-(5-chloro-2-iodo-anilino)-4-[2-keto-1-(3-pyridyl)pyrrolidin-3-ylidene]butyric acid Formula: C19H17ClIN3O3 MolecularWeight: 497.71405

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1=CCC(C(=O)O)NC2=C(C=CC(=C2)Cl)I)C3=CN=CC=C3

Isomeric SMILES

C\1CN(C(=O)/C1=C\CC(C(=O)O)NC2=C(C=CC(=C2)Cl)I)C3=CN=CC=C3

InChI

InChI=1S/C19H17ClIN3O3/c20-13-4-5-15(21)17(10-13)23-16(19(26)27)6-3-12-7-9-24(18(12)25)14-2-1-8-22-11-14/h1-5,8,10-11,16,23H,6-7,9H2,(H,26,27)/b12-3-