N-[(E)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-1-nitro-ethenyl]benzamide

Systemtic Name: N-[(E)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-1-nitro-ethenyl]benzamide Openeye Name: N-[(E)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-1-nitro-vinyl]benzamide CAS Name: N-[(E)-2-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-1-nitroethenyl]benzamide IUPAC Name: N-[(E)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-1-nitroethenyl]benzamide Traditional Name: N-[(E)-2-[(2S)-2-(methoxymethyl)pyrrolidino]-1-nitro-vinyl]benzamide Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1C=C(NC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC[C@@H]1CCCN1/C=C(\NC(=O)C2=CC=CC=C2)/[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O4/c1-22-11-13-8-5-9-17(13)10-14(18(20)21)16-15(19)12-6-3-2-4-7-12/h2-4,6-7,10,13H,5,8-9,11H2,1H3,(H,16,19)/b14-10+/t13-/m0/s1