N-[(E)-(4-nitro-1-phenyl-pyrrol-2-yl)methylideneamino]pentanamide

Systemtic Name: N-[(E)-(4-nitro-1-phenyl-pyrrol-2-yl)methylideneamino]pentanamide Openeye Name: N-[(E)-(4-nitro-1-phenyl-pyrrol-2-yl)methyleneamino]pentanamide CAS Name: N-[(E)-(4-nitro-1-phenyl-2-pyrrolyl)methylideneamino]pentanamide IUPAC Name: N-[(E)-(4-nitro-1-phenylpyrrol-2-yl)methylideneamino]pentanamide Traditional Name: N-[(E)-(4-nitro-1-phenyl-pyrrol-2-yl)methyleneamino]valeramide Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NN=CC1=CC(=CN1C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)N/N=C/C1=CC(=CN1C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O3/c1-2-3-9-16(21)18-17-11-14-10-15(20(22)23)12-19(14)13-7-5-4-6-8-13/h4-8,10-12H,2-3,9H2,1H3,(H,18,21)/b17-11+