5-nitro-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-nitro-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(isopropylamino)-2-oxo-ethyl]-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: 5-nitro-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-nitro-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(isopropylamino)-2-keto-ethyl]-5-nitro-2-pyrrolidino-benzamide Formula: C16H22N4O4 MolecularWeight: 334.37028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C16H22N4O4/c1-11(2)18-15(21)10-17-16(22)13-9-12(20(23)24)5-6-14(13)19-7-3-4-8-19/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,17,22)(H,18,21)