N-[3-(2-diethylaminoethylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(2-diethylaminoethylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(2-diethylaminoethylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(2-diethylaminoethylamino)-oxomethyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(2-diethylaminoethylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(2-diethylaminoethylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazino]phenyl]-piperonylamide Formula: C32H39N5O5 MolecularWeight: 573.68256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C32H39N5O5/c1-4-35(5-2)15-14-33-32(39)25-21-24(34-31(38)23-10-13-29-30(20-23)42-22-41-29)11-12-26(25)36-16-18-37(19-17-36)27-8-6-7-9-28(27)40-3/h6-13,20-21H,4-5,14-19,22H2,1-3H3,(H,33,39)(H,34,38)