4-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]-2-phenyl-morpholine

Systemtic Name: 4-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]-2-phenyl-morpholine Openeye Name: 4-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenyl]-2-phenyl-morpholine CAS Name: 4-[4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitrophenyl]-2-phenylmorpholine IUPAC Name: 4-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitrophenyl]-2-phenylmorpholine Traditional Name: 4-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]-2-phenyl-morpholine Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOC(C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOC(C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O5S/c1-22-9-11-24(12-10-22)31(28,29)18-7-8-19(20(15-18)25(26)27)23-13-14-30-21(16-23)17-5-3-2-4-6-17/h2-8,15,21H,9-14,16H2,1H3