4-[4-[(3-chloranyl-1-benzothiophen-2-yl)methoxy]-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-[(3-chloranyl-1-benzothiophen-2-yl)methoxy]-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-[(3-chlorobenzothiophen-2-yl)methoxy]-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[(3-chloro-1-benzothiophen-2-yl)methoxy]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-[(3-chloro-1-benzothiophen-2-yl)methoxy]-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-[(3-chlorobenzothiophen-2-yl)methoxy]-3-nitro-phenyl]sulfonylmorpholine Formula: C19H17ClN2O6S2 MolecularWeight: 468.93108

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC3=C(C4=CC=CC=C4S3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC3=C(C4=CC=CC=C4S3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN2O6S2/c20-19-14-3-1-2-4-17(14)29-18(19)12-28-16-6-5-13(11-15(16)22(23)24)30(25,26)21-7-9-27-10-8-21/h1-6,11H,7-10,12H2