3-methylbutyl 2-[1-[2-(4-methoxyphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[1-[2-(4-methoxyphenoxy)propanoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[1-[2-(4-methoxyphenoxy)propanoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(4-methoxyphenoxy)-1-oxopropyl]-3-oxo-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[1-[2-(4-methoxyphenoxy)propanoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(4-methoxyphenoxy)propanoyl]piperazin-2-yl]acetic acid isoamyl ester Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C(C)OC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H30N2O6/c1-14(2)9-12-28-19(24)13-18-20(25)22-10-11-23(18)21(26)15(3)29-17-7-5-16(27-4)6-8-17/h5-8,14-15,18H,9-13H2,1-4H3,(H,22,25)