4-bromanyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-[(2-morpholinosulfonylphenyl)methyl]-3-nitro-benzamide CAS Name: 4-bromo-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitrobenzamide Traditional Name: 4-bromo-N-(2-morpholinosulfonylbenzyl)-3-nitro-benzamide Formula: C18H18BrN3O6S MolecularWeight: 484.32102

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H18BrN3O6S/c19-15-6-5-13(11-16(15)22(24)25)18(23)20-12-14-3-1-2-4-17(14)29(26,27)21-7-9-28-10-8-21/h1-6,11H,7-10,12H2,(H,20,23)