1-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chloranyl-6-methyl-quinolin-3-yl)methyl]-3,3-dimethyl-urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chloranyl-6-methyl-quinolin-3-yl)methyl]-3,3-dimethyl-urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chloro-6-methyl-3-quinolyl)methyl]-3,3-dimethyl-urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chloro-6-methyl-3-quinolinyl)methyl]-3,3-dimethylurea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chloro-6-methylquinolin-3-yl)methyl]-3,3-dimethylurea Traditional Name: 1-[(2-chloro-6-methyl-3-quinolyl)methyl]-3,3-dimethyl-1-piperonyl-urea Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)Cl)CN(CC3=CC4=C(C=C3)OCO4)C(=O)N(C)C

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)Cl)CN(CC3=CC4=C(C=C3)OCO4)C(=O)N(C)C

InChI

InChI=1S/C22H22ClN3O3/c1-14-4-6-18-16(8-14)10-17(21(23)24-18)12-26(22(27)25(2)3)11-15-5-7-19-20(9-15)29-13-28-19/h4-10H,11-13H2,1-3H3