ethyl N,N-bis[(6-propyl-1,3-benzodioxol-5-yl)methyl]carbamimidate

Systemtic Name: ethyl N,N-bis[(6-propyl-1,3-benzodioxol-5-yl)methyl]carbamimidate Openeye Name: 2-ethyl-1,1-bis[(6-propyl-1,3-benzodioxol-5-yl)methyl]isourea CAS Name: N,N-bis[(6-propyl-1,3-benzodioxol-5-yl)methyl]carbamimidic acid ethyl ester IUPAC Name: ethyl N,N-bis[(6-propyl-1,3-benzodioxol-5-yl)methyl]carbamimidate Traditional Name: 2-ethyl-1,1-bis[(6-propyl-1,3-benzodioxol-5-yl)methyl]isourea Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1CN(CC3=CC4=C(C=C3CCC)OCO4)C(=N)OCC)OCO2

Isomeric SMILES

CCCC1=CC2=C(C=C1CN(CC3=CC4=C(C=C3CCC)OCO4)C(=N)OCC)OCO2

InChI

InChI=1S/C25H32N2O5/c1-4-7-17-9-21-23(31-15-29-21)11-19(17)13-27(25(26)28-6-3)14-20-12-24-22(30-16-32-24)10-18(20)8-5-2/h9-12,26H,4-8,13-16H2,1-3H3