4-[(E)-1-morpholin-4-yl-2-(5-nitrothiophen-2-yl)ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-1-morpholin-4-yl-2-(5-nitrothiophen-2-yl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-1-morpholino-2-(5-nitro-2-thienyl)vinyl]benzonitrile CAS Name: 4-[(E)-1-(4-morpholinyl)-2-(5-nitro-2-thiophenyl)ethenyl]benzonitrile IUPAC Name: 4-[(E)-1-morpholin-4-yl-2-(5-nitrothiophen-2-yl)ethenyl]benzonitrile Traditional Name: 4-[(E)-1-morpholino-2-(5-nitro-2-thienyl)vinyl]benzonitrile Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=CC2=CC=C(S2)[N+](=O)[O-])C3=CC=C(C=C3)C#N

Isomeric SMILES

C1COCCN1/C(=C/C2=CC=C(S2)[N+](=O)[O-])/C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H15N3O3S/c18-12-13-1-3-14(4-2-13)16(19-7-9-23-10-8-19)11-15-5-6-17(24-15)20(21)22/h1-6,11H,7-10H2/b16-11+