2-[(3-morpholin-4-ylsulfonylphenyl)amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(3-morpholin-4-ylsulfonylphenyl)amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-(3-morpholinosulfonylanilino)-5-nitro-benzonitrile CAS Name: 2-[3-(4-morpholinylsulfonyl)anilino]-5-nitrobenzonitrile IUPAC Name: 2-(3-morpholin-4-ylsulfonylanilino)-5-nitrobenzonitrile Traditional Name: 2-(3-morpholinosulfonylanilino)-5-nitro-benzonitrile Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H16N4O5S/c18-12-13-10-15(21(22)23)4-5-17(13)19-14-2-1-3-16(11-14)27(24,25)20-6-8-26-9-7-20/h1-5,10-11,19H,6-9H2