N-[3-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(4-methoxy-3-morpholinosulfonyl-anilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[4-methoxy-3-(4-morpholinylsulfonyl)anilino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(4-methoxy-3-morpholin-4-ylsulfonylanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-(4-methoxy-3-morpholinosulfonyl-anilino)propyl]-4-nitro-benzamide Formula: C21H24N4O8S MolecularWeight: 492.50226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H24N4O8S/c1-32-18-7-4-16(14-19(18)34(30,31)24-10-12-33-13-11-24)23-20(26)8-9-22-21(27)15-2-5-17(6-3-15)25(28)29/h2-7,14H,8-13H2,1H3,(H,22,27)(H,23,26)