propan-2-yl 2-[(2S)-1-[2-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: propan-2-yl 2-[(2S)-1-[2-(3-methylbutoxy)phenyl]carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopropyl 2-[(2S)-1-(2-isopentyloxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[(2S)-1-[[2-(3-methylbutoxy)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(2S)-1-[2-(3-methylbutoxy)benzoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[(2S)-1-(2-isoamoxybenzoyl)-3-keto-piperazin-2-yl]acetic acid isopropyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC=C1C(=O)N2CCNC(=O)C2CC(=O)OC(C)C

Isomeric SMILES

CC(C)CCOC1=CC=CC=C1C(=O)N2CCNC(=O)[C@@H]2CC(=O)OC(C)C

InChI

InChI=1S/C21H30N2O5/c1-14(2)9-12-27-18-8-6-5-7-16(18)21(26)23-11-10-22-20(25)17(23)13-19(24)28-15(3)4/h5-8,14-15,17H,9-13H2,1-4H3,(H,22,25)/t17-/m0/s1