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

Systemtic Name: 5-chloranyl-N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-2-nitro-benzamide Openeye Name: 5-chloro-N-(4-methoxy-3-morpholinosulfonyl-phenyl)-2-nitro-benzamide CAS Name: 5-chloro-N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-2-nitrobenzamide Traditional Name: 5-chloro-N-(4-methoxy-3-morpholinosulfonyl-phenyl)-2-nitro-benzamide Formula: C18H18ClN3O7S MolecularWeight: 455.86942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H18ClN3O7S/c1-28-16-5-3-13(11-17(16)30(26,27)21-6-8-29-9-7-21)20-18(23)14-10-12(19)2-4-15(14)22(24)25/h2-5,10-11H,6-9H2,1H3,(H,20,23)