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

Systemtic Name: N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazino]phenyl]-piperonylamide Formula: C29H30N4O5 MolecularWeight: 514.5723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5)C(=O)NC6CC6

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5)C(=O)NC6CC6

InChI

InChI=1S/C29H30N4O5/c1-36-25-5-3-2-4-24(25)33-14-12-32(13-15-33)23-10-9-21(17-22(23)29(35)30-20-7-8-20)31-28(34)19-6-11-26-27(16-19)38-18-37-26/h2-6,9-11,16-17,20H,7-8,12-15,18H2,1H3,(H,30,35)(H,31,34)