4-(4-chloranyl-3-ethoxy-phenyl)sulfinylazepan-2-one

Systemtic Name: 4-(4-chloranyl-3-ethoxy-phenyl)sulfinylazepan-2-one Openeye Name: 4-(4-chloro-3-ethoxy-phenyl)sulfinylazepan-2-one CAS Name: 4-(4-chloro-3-ethoxyphenyl)sulfinyl-2-azepanone IUPAC Name: 4-(4-chloro-3-ethoxyphenyl)sulfinylazepan-2-one Traditional Name: 4-(4-chloro-3-ethoxy-phenyl)sulfinylazepan-2-one Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)S(=O)C2CCCNC(=O)C2)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)S(=O)C2CCCNC(=O)C2)Cl

InChI

InChI=1S/C14H18ClNO3S/c1-2-19-13-8-11(5-6-12(13)15)20(18)10-4-3-7-16-14(17)9-10/h5-6,8,10H,2-4,7,9H2,1H3,(H,16,17)