(E)-3-(4-morpholin-4-ylphenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid

Systemtic Name: (E)-3-(4-morpholin-4-ylphenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid Openeye Name: (E)-3-(4-morpholinophenyl)-2-(4-nitrophenyl)sulfanyl-prop-2-enoic acid CAS Name: (E)-3-[4-(4-morpholinyl)phenyl]-2-[(4-nitrophenyl)thio]-2-propenoic acid IUPAC Name: (E)-3-(4-morpholin-4-ylphenyl)-2-(4-nitrophenyl)sulfanylprop-2-enoic acid Traditional Name: (E)-3-(4-morpholinophenyl)-2-[(4-nitrophenyl)thio]acrylic acid Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C=C(C(=O)O)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)/C=C(\C(=O)O)/SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5S/c22-19(23)18(27-17-7-5-16(6-8-17)21(24)25)13-14-1-3-15(4-2-14)20-9-11-26-12-10-20/h1-8,13H,9-12H2,(H,22,23)/b18-13+