N-(4-ethoxyphenyl)-N'-[(E)-(5-nitrothiophen-2-yl)methylideneamino]butanediamide

Systemtic Name: N-(4-ethoxyphenyl)-N'-[(E)-(5-nitrothiophen-2-yl)methylideneamino]butanediamide Openeye Name: N-(4-ethoxyphenyl)-N'-[(E)-(5-nitro-2-thienyl)methyleneamino]butanediamide CAS Name: N-(4-ethoxyphenyl)-N'-[(E)-(5-nitro-2-thiophenyl)methylideneamino]butanediamide IUPAC Name: N-(4-ethoxyphenyl)-N'-[(E)-(5-nitrothiophen-2-yl)methylideneamino]butanediamide Traditional Name: N'-[(E)-(5-nitro-2-thienyl)methyleneamino]-N-p-phenetyl-succinamide Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NN=CC2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S/c1-2-26-13-5-3-12(4-6-13)19-15(22)8-9-16(23)20-18-11-14-7-10-17(27-14)21(24)25/h3-7,10-11H,2,8-9H2,1H3,(H,19,22)(H,20,23)/b18-11+