1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-3-(2-oxidanylideneazepan-3-yl)urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-3-(2-oxidanylideneazepan-3-yl)urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-3-(2-oxoazepan-3-yl)urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-3-(2-oxo-3-azepanyl)urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-3-(2-oxoazepan-3-yl)urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-ethyl-3-(2-ketoazepan-3-yl)urea Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)C(=O)NC3CCCCNC3=O

Isomeric SMILES

CCN(CC1COC2=CC=CC=C2O1)C(=O)NC3CCCCNC3=O

InChI

InChI=1S/C18H25N3O4/c1-2-21(18(23)20-14-7-5-6-10-19-17(14)22)11-13-12-24-15-8-3-4-9-16(15)25-13/h3-4,8-9,13-14H,2,5-7,10-12H2,1H3,(H,19,22)(H,20,23)