1-(8-azanyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ethyl-urea

Systemtic Name: 1-(8-azanyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ethyl-urea Openeye Name: 1-(8-amino-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ethyl-urea CAS Name: 1-(8-amino-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ethylurea IUPAC Name: 1-(8-amino-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ethylurea Traditional Name: 1-(8-amino-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-ethyl-urea Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC2=C(C=C1N)OCCCO2

Isomeric SMILES

CCNC(=O)NC1=CC2=C(C=C1N)OCCCO2

InChI

InChI=1S/C12H17N3O3/c1-2-14-12(16)15-9-7-11-10(6-8(9)13)17-4-3-5-18-11/h6-7H,2-5,13H2,1H3,(H2,14,15,16)