3-methylbutyl 2-[1-(4-methoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[1-(4-methoxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[1-(4-methoxybenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(4-methoxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[1-(4-methoxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-(3-keto-1-p-anisoyl-piperazin-2-yl)acetic acid isoamyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O5/c1-13(2)8-11-26-17(22)12-16-18(23)20-9-10-21(16)19(24)14-4-6-15(25-3)7-5-14/h4-7,13,16H,8-12H2,1-3H3,(H,20,23)