(2R)-2-(3-methyl-4-nitro-phenoxy)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]butanamide

Systemtic Name: (2R)-2-(3-methyl-4-nitro-phenoxy)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]butanamide Openeye Name: (2R)-2-(3-methyl-4-nitro-phenoxy)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide CAS Name: (2R)-2-(3-methyl-4-nitrophenoxy)-N-[3-(2-oxo-1-pyrrolidinyl)propyl]butanamide IUPAC Name: (2R)-2-(3-methyl-4-nitrophenoxy)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide Traditional Name: (2R)-N-[3-(2-ketopyrrolidino)propyl]-2-(3-methyl-4-nitro-phenoxy)butyramide Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCCN1CCCC1=O)OC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC[C@H](C(=O)NCCCN1CCCC1=O)OC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H25N3O5/c1-3-16(26-14-7-8-15(21(24)25)13(2)12-14)18(23)19-9-5-11-20-10-4-6-17(20)22/h7-8,12,16H,3-6,9-11H2,1-2H3,(H,19,23)/t16-/m1/s1