1-(2-azanylpropanoylamino)-3-(1,3-benzodioxol-4-ylmethyl)urea

Systemtic Name: 1-(2-azanylpropanoylamino)-3-(1,3-benzodioxol-4-ylmethyl)urea Openeye Name: 1-(2-aminopropanoylamino)-3-(1,3-benzodioxol-4-ylmethyl)urea CAS Name: 1-[(2-amino-1-oxopropyl)amino]-3-(1,3-benzodioxol-4-ylmethyl)urea IUPAC Name: 1-(2-aminopropanoylamino)-3-(1,3-benzodioxol-4-ylmethyl)urea Traditional Name: 1-(alanylamino)-3-(1,3-benzodioxol-4-ylmethyl)urea Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)NCC1=C2C(=CC=C1)OCO2)N

Isomeric SMILES

CC(C(=O)NNC(=O)NCC1=C2C(=CC=C1)OCO2)N

InChI

InChI=1S/C12H16N4O4/c1-7(13)11(17)15-16-12(18)14-5-8-3-2-4-9-10(8)20-6-19-9/h2-4,7H,5-6,13H2,1H3,(H,15,17)(H2,14,16,18)