ethyl 1-[(1S)-1-(2-methoxyphenyl)-2-nitro-ethyl]-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: ethyl 1-[(1S)-1-(2-methoxyphenyl)-2-nitro-ethyl]-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: ethyl 1-[(1S)-1-(2-methoxyphenyl)-2-nitro-ethyl]-2-oxo-cyclopentanecarboxylate CAS Name: 1-[(1S)-1-(2-methoxyphenyl)-2-nitroethyl]-2-oxo-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1S)-1-(2-methoxyphenyl)-2-nitroethyl]-2-oxocyclopentane-1-carboxylate Traditional Name: 2-keto-1-[(1S)-1-(2-methoxyphenyl)-2-nitro-ethyl]cyclopentanecarboxylic acid ethyl ester Formula: C17H21NO6 MolecularWeight: 335.35174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCC1=O)C(C[N+](=O)[O-])C2=CC=CC=C2OC

Isomeric SMILES

CCOC(=O)C1(CCCC1=O)[C@@H](C[N+](=O)[O-])C2=CC=CC=C2OC

InChI

InChI=1S/C17H21NO6/c1-3-24-16(20)17(10-6-9-15(17)19)13(11-18(21)22)12-7-4-5-8-14(12)23-2/h4-5,7-8,13H,3,6,9-11H2,1-2H3/t13-,17?/m0/s1