1,1-dibutyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidin-3-yl]urea

Systemtic Name: 1,1-dibutyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1,1-dibutyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1,1-dibutyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1,1-dibutyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1,1-dibutyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-pyrrolidin-3-yl]urea Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)NC1CC(=O)N(C1)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCN(CCCC)C(=O)NC1CC(=O)N(C1)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H31N3O4/c1-3-5-9-23(10-6-4-2)21(26)22-16-13-20(25)24(15-16)17-7-8-18-19(14-17)28-12-11-27-18/h7-8,14,16H,3-6,9-13,15H2,1-2H3,(H,22,26)