N,N-diethyl-4-[(4-morpholin-4-ylphenyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(4-morpholin-4-ylphenyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-(4-morpholinoanilino)-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[4-(4-morpholinyl)anilino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-(4-morpholin-4-ylanilino)-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-(4-morpholinoanilino)-3-nitro-benzenesulfonamide Formula: C20H26N4O5S MolecularWeight: 434.50924

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5S/c1-3-23(4-2)30(27,28)18-9-10-19(20(15-18)24(25)26)21-16-5-7-17(8-6-16)22-11-13-29-14-12-22/h5-10,15,21H,3-4,11-14H2,1-2H3