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

Systemtic Name: 3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[[2-(morpholinosulfonylmethyl)phenyl]methyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[[2-(4-morpholinylsulfonylmethyl)phenyl]methyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[2-(morpholinosulfonylmethyl)benzyl]-4-nitro-benzamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c1-15-12-16(6-7-19(15)23(25)26)20(24)21-13-17-4-2-3-5-18(17)14-30(27,28)22-8-10-29-11-9-22/h2-7,12H,8-11,13-14H2,1H3,(H,21,24)