N-[3-[(3-morpholin-4-ylsulfonylphenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(3-morpholin-4-ylsulfonylphenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(3-morpholinosulfonylanilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[3-(4-morpholinylsulfonyl)anilino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(3-morpholin-4-ylsulfonylanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-(3-morpholinosulfonylanilino)propyl]-4-nitro-benzamide Formula: C20H22N4O7S MolecularWeight: 462.47628

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O7S/c25-19(8-9-21-20(26)15-4-6-17(7-5-15)24(27)28)22-16-2-1-3-18(14-16)32(29,30)23-10-12-31-13-11-23/h1-7,14H,8-13H2,(H,21,26)(H,22,25)