ethyl (E)-3-morpholin-4-yl-2-(2-nitrophenyl)sulfanyl-but-2-enoate

Systemtic Name: ethyl (E)-3-morpholin-4-yl-2-(2-nitrophenyl)sulfanyl-but-2-enoate Openeye Name: ethyl (E)-3-morpholino-2-(2-nitrophenyl)sulfanyl-but-2-enoate CAS Name: (E)-3-(4-morpholinyl)-2-[(2-nitrophenyl)thio]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-morpholin-4-yl-2-(2-nitrophenyl)sulfanylbut-2-enoate Traditional Name: (E)-3-morpholino-2-[(2-nitrophenyl)thio]but-2-enoic acid ethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)N1CCOCC1)SC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C(=C(/C)\N1CCOCC1)/SC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O5S/c1-3-23-16(19)15(12(2)17-8-10-22-11-9-17)24-14-7-5-4-6-13(14)18(20)21/h4-7H,3,8-11H2,1-2H3/b15-12+