2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-[ethyl(piperonyl)amino]-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3/c1-2-23(13-16-8-9-19-20(12-16)27-15-26-19)14-21(25)24-11-10-18(22-24)17-6-4-3-5-7-17/h3-9,12H,2,10-11,13-15H2,1H3