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

Systemtic Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitro-benzamide Openeye Name: N-[(2-morpholinosulfonylphenyl)methyl]-3-nitro-benzamide CAS Name: N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-nitrobenzamide Traditional Name: N-(2-morpholinosulfonylbenzyl)-3-nitro-benzamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6S/c22-18(14-5-3-6-16(12-14)21(23)24)19-13-15-4-1-2-7-17(15)28(25,26)20-8-10-27-11-9-20/h1-7,12H,8-11,13H2,(H,19,22)