3-phenylpropyl 2-[1-(4-chloranylbutanoyl)-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-phenylpropyl 2-[1-(4-chloranylbutanoyl)-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 3-phenylpropyl 2-[1-(4-chlorobutanoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(4-chloro-1-oxobutyl)-3-oxo-2-piperazinyl]acetic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-[1-(4-chlorobutanoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-chlorobutanoyl)-3-keto-piperazin-2-yl]acetic acid 3-phenylpropyl ester Formula: C19H25ClN2O4 MolecularWeight: 380.8658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)OCCCC2=CC=CC=C2)C(=O)CCCCl

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)OCCCC2=CC=CC=C2)C(=O)CCCCl

InChI

InChI=1S/C19H25ClN2O4/c20-10-4-9-17(23)22-12-11-21-19(25)16(22)14-18(24)26-13-5-8-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14H2,(H,21,25)