2-morpholin-4-ylethylimino-(4-nitrophenyl)-oxidanylidene-(3-phenoxypropyl)-$l^{6}-sulfane

Systemtic Name: 2-morpholin-4-ylethylimino-(4-nitrophenyl)-oxidanylidene-(3-phenoxypropyl)-$l^{6}-sulfane Openeye Name: 2-morpholinoethylimino-(4-nitrophenyl)-oxo-(3-phenoxypropyl)-$l^{6}-sulfane CAS Name: 2-(4-morpholinyl)ethylimino-(4-nitrophenyl)-oxo-(3-phenoxypropyl)-$l^{6}-sulfane IUPAC Name: 2-morpholin-4-ylethylimino-(4-nitrophenyl)-oxo-(3-phenoxypropyl)-$l^{6}-sulfane Traditional Name: keto-(2-morpholinoethylimino)-(4-nitrophenyl)-(3-phenoxypropyl)-$l^{6}-sulfane Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN=S(=O)(CCCOC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCN=S(=O)(CCCOC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O5S/c25-24(26)19-7-9-21(10-8-19)30(27,22-11-12-23-13-16-28-17-14-23)18-4-15-29-20-5-2-1-3-6-20/h1-3,5-10H,4,11-18H2