N-[(4E)-4-(5-chloranyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]pentanamide

Systemtic Name: N-[(4E)-4-(5-chloranyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]pentanamide Openeye Name: N-[(4E)-4-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]pentanamide CAS Name: N-[(4E)-4-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]pentanamide IUPAC Name: N-[(4E)-4-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]pentanamide Traditional Name: N-[(4E)-4-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]valeramide Formula: C18H17ClN2O3 MolecularWeight: 344.79218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=O)C(=C2NC3=C(O2)C=CC(=C3)Cl)C=C1

Isomeric SMILES

CCCCC(=O)NC1=CC(=O)/C(=C/2\NC3=C(O2)C=CC(=C3)Cl)/C=C1

InChI

InChI=1S/C18H17ClN2O3/c1-2-3-4-17(23)20-12-6-7-13(15(22)10-12)18-21-14-9-11(19)5-8-16(14)24-18/h5-10,21H,2-4H2,1H3,(H,20,23)/b18-13+