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

Systemtic Name: N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-(4-chloro-3-nitro-benzylidene)amino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C17H16ClN5O7S MolecularWeight: 469.85624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN5O7S/c18-14-3-1-12(9-16(14)22(24)25)11-19-20-15-4-2-13(10-17(15)23(26)27)31(28,29)21-5-7-30-8-6-21/h1-4,9-11,20H,5-8H2/b19-11+