N-[(E)-(4-butoxyphenyl)methylideneamino]-2-[(3-nitrophenyl)carbamoylamino]ethanamide

Systemtic Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-[(3-nitrophenyl)carbamoylamino]ethanamide Openeye Name: N-[(E)-(4-butoxyphenyl)methyleneamino]-2-[(3-nitrophenyl)carbamoylamino]acetamide CAS Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-[[(3-nitroanilino)-oxomethyl]amino]acetamide IUPAC Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-[(3-nitrophenyl)carbamoylamino]acetamide Traditional Name: N-[(E)-(4-butoxybenzylidene)amino]-2-[(3-nitrophenyl)carbamoylamino]acetamide Formula: C20H23N5O5 MolecularWeight: 413.42712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=O)CNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/NC(=O)CNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O5/c1-2-3-11-30-18-9-7-15(8-10-18)13-22-24-19(26)14-21-20(27)23-16-5-4-6-17(12-16)25(28)29/h4-10,12-13H,2-3,11,14H2,1H3,(H,24,26)(H2,21,23,27)/b22-13+