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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

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