ethyl 2-[(2S)-1-[(2S)-2-(2-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2S)-1-[(2S)-2-(2-nitrophenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[(2S)-1-[(2S)-2-(2-nitrophenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[(2S)-2-(2-nitrophenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S)-1-[(2S)-2-(2-nitrophenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-1-[(2S)-2-(2-nitrophenoxy)propanoyl]piperazin-2-yl]acetic acid ethyl ester Formula: C17H21N3O7 MolecularWeight: 379.36454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C[C@H]1C(=O)NCCN1C(=O)[C@H](C)OC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O7/c1-3-26-15(21)10-13-16(22)18-8-9-19(13)17(23)11(2)27-14-7-5-4-6-12(14)20(24)25/h4-7,11,13H,3,8-10H2,1-2H3,(H,18,22)/t11-,13-/m0/s1