3-chloranyl-4-[2-[(3,4-dimethyl-1,2-oxazol-5-yl)methylsulfonyl]phenyl]benzaldehyde

Systemtic Name: 3-chloranyl-4-[2-[(3,4-dimethyl-1,2-oxazol-5-yl)methylsulfonyl]phenyl]benzaldehyde Openeye Name: 3-chloro-4-[2-[(3,4-dimethylisoxazol-5-yl)methylsulfonyl]phenyl]benzaldehyde CAS Name: 3-chloro-4-[2-[(3,4-dimethyl-5-isoxazolyl)methylsulfonyl]phenyl]benzaldehyde IUPAC Name: 3-chloro-4-[2-[(3,4-dimethyl-1,2-oxazol-5-yl)methylsulfonyl]phenyl]benzaldehyde Traditional Name: 3-chloro-4-[2-[(3,4-dimethylisoxazol-5-yl)methylsulfonyl]phenyl]benzaldehyde Formula: C19H16ClNO4S MolecularWeight: 389.85264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)CS(=O)(=O)C2=CC=CC=C2C3=C(C=C(C=C3)C=O)Cl

Isomeric SMILES

CC1=C(ON=C1C)CS(=O)(=O)C2=CC=CC=C2C3=C(C=C(C=C3)C=O)Cl

InChI

InChI=1S/C19H16ClNO4S/c1-12-13(2)21-25-18(12)11-26(23,24)19-6-4-3-5-16(19)15-8-7-14(10-22)9-17(15)20/h3-10H,11H2,1-2H3