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

Systemtic Name: 2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)benzenecarbonitrile Openeye Name: 2-(4-morpholinosulfonyl-2-nitro-phenoxy)benzonitrile CAS Name: 2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]benzonitrile IUPAC Name: 2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)benzonitrile Traditional Name: 2-(4-morpholinosulfonyl-2-nitro-phenoxy)benzonitrile Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC=C3C#N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC=C3C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O6S/c18-12-13-3-1-2-4-16(13)26-17-6-5-14(11-15(17)20(21)22)27(23,24)19-7-9-25-10-8-19/h1-6,11H,7-10H2