N-[2-(3,4-dichlorophenyl)-6-(diethylamino)-1-morpholin-4-yl-3-oxidanylidene-4,2,1$l^{5}-benzoxazaphosphinin-1-ylidene]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dichlorophenyl)-6-(diethylamino)-1-morpholin-4-yl-3-oxidanylidene-4,2,1$l^{5}-benzoxazaphosphinin-1-ylidene]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dichlorophenyl)-6-(diethylamino)-1-morpholino-3-oxo-4,2,1$l^{5}-benzoxazaphosphinin-1-ylidene]-4-methyl-benzenesulfonamide CAS Name: N-[2-(3,4-dichlorophenyl)-6-(diethylamino)-1-(4-morpholinyl)-3-oxo-4,2,1$l^{5}-benzoxazaphosphorin-1-ylidene]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(3,4-dichlorophenyl)-6-(diethylamino)-1-morpholin-4-yl-3-oxo-4,2,1$l^{5}-benzoxazaphosphinin-1-ylidene]-4-methylbenzenesulfonamide Traditional Name: N-[2-(3,4-dichlorophenyl)-6-(diethylamino)-3-keto-1-morpholino-4,2,1$l^{5}-benzoxazaphosphorin-1-ylidene]-4-methyl-benzenesulfonamide Formula: C28H31Cl2N4O5PS MolecularWeight: 637.514301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)P(=NS(=O)(=O)C3=CC=C(C=C3)C)(N(C(=O)O2)C4=CC(=C(C=C4)Cl)Cl)N5CCOCC5

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)P(=NS(=O)(=O)C3=CC=C(C=C3)C)(N(C(=O)O2)C4=CC(=C(C=C4)Cl)Cl)N5CCOCC5

InChI

InChI=1S/C28H31Cl2N4O5PS/c1-4-32(5-2)21-9-13-27-26(19-21)39-28(35)34(22-8-12-24(29)25(30)18-22)40(27,33-14-16-38-17-15-33)31-41(36,37)23-10-6-20(3)7-11-23/h6-13,18-19H,4-5,14-17H2,1-3H3