ethyl (3S)-1-[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-oxo-2-[4-(2-oxo-1-pyrrolidinyl)anilino]ethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-keto-2-[4-(2-ketopyrrolidino)anilino]ethyl]nipecotic acid ethyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)CC(=O)NC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C20H27N3O4/c1-2-27-20(26)15-5-3-11-22(13-15)14-18(24)21-16-7-9-17(10-8-16)23-12-4-6-19(23)25/h7-10,15H,2-6,11-14H2,1H3,(H,21,24)/t15-/m0/s1