ethyl 4-[4-[1-(4-methylphenyl)imidazol-2-yl]piperazin-1-yl]-4-oxidanylidene-butanoate hydrochloride

Systemtic Name: ethyl 4-[4-[1-(4-methylphenyl)imidazol-2-yl]piperazin-1-yl]-4-oxidanylidene-butanoate hydrochloride Openeye Name: ethyl 4-oxo-4-[4-[1-(p-tolyl)imidazol-2-yl]piperazin-1-yl]butanoate hydrochloride CAS Name: 4-[4-[1-(4-methylphenyl)-2-imidazolyl]-1-piperazinyl]-4-oxobutanoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[4-[1-(4-methylphenyl)imidazol-2-yl]piperazin-1-yl]-4-oxobutanoate hydrochloride Traditional Name: 4-keto-4-[4-[1-(p-tolyl)imidazol-2-yl]piperazino]butyric acid ethyl ester hydrochloride Formula: C20H27ClN4O3 MolecularWeight: 406.90638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCN(CC1)C2=NC=CN2C3=CC=C(C=C3)C.Cl

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCN(CC1)C2=NC=CN2C3=CC=C(C=C3)C.Cl

InChI

InChI=1S/C20H26N4O3.ClH/c1-3-27-19(26)9-8-18(25)22-12-14-23(15-13-22)20-21-10-11-24(20)17-6-4-16(2)5-7-17;/h4-7,10-11H,3,8-9,12-15H2,1-2H3;1H