4-[(E)-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)hydrazinylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-[(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)hydrazinylidene]methyl]benzenecarbonitrile Openeye Name: 4-[(E)-[(4-morpholinosulfonyl-2-nitro-phenyl)hydrazono]methyl]benzonitrile CAS Name: 4-[(E)-[[4-(4-morpholinylsulfonyl)-2-nitrophenyl]hydrazinylidene]methyl]benzonitrile IUPAC Name: 4-[(E)-[(4-morpholin-4-ylsulfonyl-2-nitrophenyl)hydrazinylidene]methyl]benzonitrile Traditional Name: 4-[(E)-[(4-morpholinosulfonyl-2-nitro-phenyl)hydrazono]methyl]benzonitrile Formula: C18H17N5O5S MolecularWeight: 415.42308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5O5S/c19-12-14-1-3-15(4-2-14)13-20-21-17-6-5-16(11-18(17)23(24)25)29(26,27)22-7-9-28-10-8-22/h1-6,11,13,21H,7-10H2/b20-13+