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

Systemtic Name: N-[3-(3-ethoxypropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(3-ethoxypropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(3-ethoxypropylamino)-oxomethyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(3-ethoxypropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(3-ethoxypropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazino]phenyl]-piperonylamide Formula: C31H36N4O6 MolecularWeight: 560.64074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H36N4O6/c1-3-39-18-6-13-32-31(37)24-20-23(33-30(36)22-9-12-28-29(19-22)41-21-40-28)10-11-25(24)34-14-16-35(17-15-34)26-7-4-5-8-27(26)38-2/h4-5,7-12,19-20H,3,6,13-18,21H2,1-2H3,(H,32,37)(H,33,36)