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

Systemtic Name: 4-azanyl-N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-3-nitro-benzamide Openeye Name: 4-amino-N-(4-methoxy-3-morpholinosulfonyl-phenyl)-3-nitro-benzamide CAS Name: 4-amino-N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: 4-amino-N-(4-methoxy-3-morpholinosulfonyl-phenyl)-3-nitro-benzamide Formula: C18H20N4O7S MolecularWeight: 436.439

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O7S/c1-28-16-5-3-13(11-17(16)30(26,27)21-6-8-29-9-7-21)20-18(23)12-2-4-14(19)15(10-12)22(24)25/h2-5,10-11H,6-9,19H2,1H3,(H,20,23)