3-methylbutyl 2-[3-oxidanylidene-1-[2-(4-propan-2-ylphenoxy)ethanoyl]piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[3-oxidanylidene-1-[2-(4-propan-2-ylphenoxy)ethanoyl]piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[1-[2-(4-isopropylphenoxy)acetyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[3-oxo-1-[2-(4-propan-2-ylphenoxy)acetyl]piperazin-2-yl]acetate Traditional Name: 2-[1-[2-(4-isopropylphenoxy)acetyl]-3-keto-piperazin-2-yl]acetic acid isoamyl ester Formula: C22H32N2O5 MolecularWeight: 404.49988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)COC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)COC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C22H32N2O5/c1-15(2)9-12-28-21(26)13-19-22(27)23-10-11-24(19)20(25)14-29-18-7-5-17(6-8-18)16(3)4/h5-8,15-16,19H,9-14H2,1-4H3,(H,23,27)