N2-(2-dimethylaminoethyl)-N1-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine-1,2-dicarboxamide

Systemtic Name: N2-(2-dimethylaminoethyl)-N1-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine-1,2-dicarboxamide Openeye Name: 4-benzyl-N2-(2-dimethylaminoethyl)-N1-(2-furylmethyl)piperazine-1,2-dicarboxamide CAS Name: N2-(2-dimethylaminoethyl)-N1-(2-furanylmethyl)-4-(phenylmethyl)piperazine-1,2-dicarboxamide IUPAC Name: 4-benzyl-2-N-(2-dimethylaminoethyl)-1-N-(furan-2-ylmethyl)piperazine-1,2-dicarboxamide Traditional Name: 4-benzyl-N'-(2-dimethylaminoethyl)-N-(2-furfuryl)piperazine-1,2-dicarboxamide Formula: C22H31N5O3 MolecularWeight: 413.51324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1CN(CCN1C(=O)NCC2=CC=CO2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)CCNC(=O)C1CN(CCN1C(=O)NCC2=CC=CO2)CC3=CC=CC=C3

InChI

InChI=1S/C22H31N5O3/c1-25(2)11-10-23-21(28)20-17-26(16-18-7-4-3-5-8-18)12-13-27(20)22(29)24-15-19-9-6-14-30-19/h3-9,14,20H,10-13,15-17H2,1-2H3,(H,23,28)(H,24,29)