1-[[(Z)-4-(1,3-benzodioxol-5-yl)but-2-en-2-yl]amino]urea

Systemtic Name: 1-[[(Z)-4-(1,3-benzodioxol-5-yl)but-2-en-2-yl]amino]urea Openeye Name: [[(Z)-3-(1,3-benzodioxol-5-yl)-1-methyl-prop-1-enyl]amino]urea CAS Name: [[(Z)-4-(1,3-benzodioxol-5-yl)but-2-en-2-yl]amino]urea IUPAC Name: [[(Z)-4-(1,3-benzodioxol-5-yl)but-2-en-2-yl]amino]urea Traditional Name: [[(Z)-3-(1,3-benzodioxol-5-yl)-1-methyl-prop-1-enyl]amino]urea Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=CC2=C(C=C1)OCO2)NNC(=O)N

Isomeric SMILES

C/C(=C/CC1=CC2=C(C=C1)OCO2)/NNC(=O)N

InChI

InChI=1S/C12H15N3O3/c1-8(14-15-12(13)16)2-3-9-4-5-10-11(6-9)18-7-17-10/h2,4-6,14H,3,7H2,1H3,(H3,13,15,16)/b8-2-