N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[(2-morpholinosulfonylphenyl)methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(2-morpholinosulfonylbenzyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C20H21N3O8S MolecularWeight: 463.46104

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4

InChI

InChI=1S/C20H21N3O8S/c24-20(15-11-17-18(31-10-9-30-17)12-16(15)23(25)26)21-13-14-3-1-2-4-19(14)32(27,28)22-5-7-29-8-6-22/h1-4,11-12H,5-10,13H2,(H,21,24)