1-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(2,4-dimethylphenyl)urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(2,4-dimethylphenyl)urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(2,4-dimethylphenyl)urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(2,4-dimethylphenyl)urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-butyl-3-(2,4-dimethylphenyl)urea Traditional Name: 1-butyl-3-(2,4-dimethylphenyl)-1-piperonyl-urea Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC2=C(C=C1)OCO2)C(=O)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCCN(CC1=CC2=C(C=C1)OCO2)C(=O)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H26N2O3/c1-4-5-10-23(13-17-7-9-19-20(12-17)26-14-25-19)21(24)22-18-8-6-15(2)11-16(18)3/h6-9,11-12H,4-5,10,13-14H2,1-3H3,(H,22,24)