3-[(3R)-2,2-dimethyl-1-(4-nitrophenyl)carbonyl-pyrrolidin-3-yl]propanal

Systemtic Name: 3-[(3R)-2,2-dimethyl-1-(4-nitrophenyl)carbonyl-pyrrolidin-3-yl]propanal Openeye Name: 3-[(3R)-2,2-dimethyl-1-(4-nitrobenzoyl)pyrrolidin-3-yl]propanal CAS Name: 3-[(3R)-2,2-dimethyl-1-[(4-nitrophenyl)-oxomethyl]-3-pyrrolidinyl]propanal IUPAC Name: 3-[(3R)-2,2-dimethyl-1-(4-nitrobenzoyl)pyrrolidin-3-yl]propanal Traditional Name: 3-[(3R)-2,2-dimethyl-1-(4-nitrobenzoyl)pyrrolidin-3-yl]propionaldehyde Formula: C16H20N2O4 MolecularWeight: 304.341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CCC=O)C

Isomeric SMILES

CC1([C@@H](CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CCC=O)C

InChI

InChI=1S/C16H20N2O4/c1-16(2)13(4-3-11-19)9-10-17(16)15(20)12-5-7-14(8-6-12)18(21)22/h5-8,11,13H,3-4,9-10H2,1-2H3/t13-/m1/s1