1-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-3-(3,7-dimethoxyquinoxalin-2-yl)urea

Systemtic Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-3-(3,7-dimethoxyquinoxalin-2-yl)urea Openeye Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]-3-(3,7-dimethoxyquinoxalin-2-yl)urea CAS Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]-3-(3,7-dimethoxy-2-quinoxalinyl)urea IUPAC Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-3-(3,7-dimethoxyquinoxalin-2-yl)urea Traditional Name: 1-(3,7-dimethoxyquinoxalin-2-yl)-3-(1-piperonyl-4-piperidyl)urea Formula: C24H27N5O5 MolecularWeight: 465.50168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=N2)NC(=O)NC3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=N2)NC(=O)NC3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C24H27N5O5/c1-31-17-4-5-18-19(12-17)26-22(23(27-18)32-2)28-24(30)25-16-7-9-29(10-8-16)13-15-3-6-20-21(11-15)34-14-33-20/h3-6,11-12,16H,7-10,13-14H2,1-2H3,(H2,25,26,28,30)