1-(1,3-benzodioxol-5-ylcarbonylamino)-3-[2-(3,4-diethoxyphenyl)ethyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylcarbonylamino)-3-[2-(3,4-diethoxyphenyl)ethyl]urea Openeye Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-[2-(3,4-diethoxyphenyl)ethyl]urea CAS Name: 1-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-[2-(3,4-diethoxyphenyl)ethyl]urea IUPAC Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-[2-(3,4-diethoxyphenyl)ethyl]urea Traditional Name: 1-[2-(3,4-diethoxyphenyl)ethyl]-3-(piperonyloylamino)urea Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)OCC

InChI

InChI=1S/C21H25N3O6/c1-3-27-16-7-5-14(11-18(16)28-4-2)9-10-22-21(26)24-23-20(25)15-6-8-17-19(12-15)30-13-29-17/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,23,25)(H2,22,24,26)