N-[(E)-(3-fluorophenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-(3-fluorophenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-(3-fluorophenyl)methyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-(3-fluorophenyl)methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-(3-fluorophenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-(3-fluorobenzylidene)amino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C17H17FN4O5S MolecularWeight: 408.404083

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17FN4O5S/c18-14-3-1-2-13(10-14)12-19-20-16-5-4-15(11-17(16)22(23)24)28(25,26)21-6-8-27-9-7-21/h1-5,10-12,20H,6-9H2/b19-12+