4-(2-chloranyl-4-nitro-phenyl)-1-thiomorpholin-4-yl-butan-1-one

Systemtic Name: 4-(2-chloranyl-4-nitro-phenyl)-1-thiomorpholin-4-yl-butan-1-one Openeye Name: 4-(2-chloro-4-nitro-phenyl)-1-thiomorpholino-butan-1-one CAS Name: 4-(2-chloro-4-nitrophenyl)-1-thiomorpholin-4-yl-1-butanone IUPAC Name: 4-(2-chloro-4-nitrophenyl)-1-thiomorpholin-4-ylbutan-1-one Traditional Name: 4-(2-chloro-4-nitro-phenyl)-1-thiomorpholino-butan-1-one Formula: C14H17ClN2O3S MolecularWeight: 328.81438

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)CCCC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CSCCN1C(=O)CCCC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H17ClN2O3S/c15-13-10-12(17(19)20)5-4-11(13)2-1-3-14(18)16-6-8-21-9-7-16/h4-5,10H,1-3,6-9H2