3-chloranyl-4-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)benzenecarbonitrile Openeye Name: 3-chloro-4-(4-morpholinosulfonyl-2-nitro-phenoxy)benzonitrile CAS Name: 3-chloro-4-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]benzonitrile IUPAC Name: 3-chloro-4-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)benzonitrile Traditional Name: 3-chloro-4-(4-morpholinosulfonyl-2-nitro-phenoxy)benzonitrile Formula: C17H14ClN3O6S MolecularWeight: 423.82756

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=C(C=C(C=C3)C#N)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=C(C=C(C=C3)C#N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O6S/c18-14-9-12(11-19)1-3-16(14)27-17-4-2-13(10-15(17)21(22)23)28(24,25)20-5-7-26-8-6-20/h1-4,9-10H,5-8H2