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

Systemtic Name: 3-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)benzenecarbonitrile Openeye Name: 3-(4-morpholinosulfonyl-2-nitro-phenoxy)benzonitrile CAS Name: 3-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]benzonitrile IUPAC Name: 3-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)benzonitrile Traditional Name: 3-(4-morpholinosulfonyl-2-nitro-phenoxy)benzonitrile Formula: C17H15N3O6S MolecularWeight: 389.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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