N2-(2-azanylethyl)-4-(1,3-benzodioxol-5-ylmethyl)-N1-(4-methylphenyl)piperazine-1,2-dicarboxamide

Systemtic Name: N2-(2-azanylethyl)-4-(1,3-benzodioxol-5-ylmethyl)-N1-(4-methylphenyl)piperazine-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-4-(1,3-benzodioxol-5-ylmethyl)-N1-(p-tolyl)piperazine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-4-(1,3-benzodioxol-5-ylmethyl)-N1-(4-methylphenyl)piperazine-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-4-(1,3-benzodioxol-5-ylmethyl)-1-N-(4-methylphenyl)piperazine-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-4-piperonyl-N-(p-tolyl)piperazine-1,2-dicarboxamide Formula: C23H29N5O4 MolecularWeight: 439.50746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2C(=O)NCCN)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2C(=O)NCCN)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N5O4/c1-16-2-5-18(6-3-16)26-23(30)28-11-10-27(14-19(28)22(29)25-9-8-24)13-17-4-7-20-21(12-17)32-15-31-20/h2-7,12,19H,8-11,13-15,24H2,1H3,(H,25,29)(H,26,30)