2-[4-[(E)-C-methyl-N-[(3-nitrophenyl)amino]carbonimidoyl]phenoxy]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[(E)-C-methyl-N-[(3-nitrophenyl)amino]carbonimidoyl]phenoxy]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[(E)-C-methyl-N-(3-nitroanilino)carbonimidoyl]phenoxy]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(1E)-1-[(3-nitrophenyl)hydrazinylidene]ethyl]phenoxy]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[(E)-C-methyl-N-(3-nitroanilino)carbonimidoyl]phenoxy]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[(E)-C-methyl-N-(3-nitroanilino)carbonimidoyl]phenoxy]-1-pyrrolidino-ethanone Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=CC(=CC=C1)[N+](=O)[O-])C2=CC=C(C=C2)OCC(=O)N3CCCC3

Isomeric SMILES

C/C(=N\NC1=CC(=CC=C1)[N+](=O)[O-])/C2=CC=C(C=C2)OCC(=O)N3CCCC3

InChI

InChI=1S/C20H22N4O4/c1-15(21-22-17-5-4-6-18(13-17)24(26)27)16-7-9-19(10-8-16)28-14-20(25)23-11-2-3-12-23/h4-10,13,22H,2-3,11-12,14H2,1H3/b21-15+