N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-nitro-benzamide

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-3-nitro-benzamide CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-3-nitro-benzamide Formula: C17H16ClN3O6S MolecularWeight: 425.84344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O6S/c18-15-5-4-14(28(25,26)20-6-8-27-9-7-20)11-16(15)19-17(22)12-2-1-3-13(10-12)21(23)24/h1-5,10-11H,6-9H2,(H,19,22)