2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-phenethylpyrrol-3-yl)ethanone Traditional Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-[methyl(piperonyl)amino]ethanone Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN(C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN(C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H28N2O3/c1-18-13-22(19(2)27(18)12-11-20-7-5-4-6-8-20)23(28)16-26(3)15-21-9-10-24-25(14-21)30-17-29-24/h4-10,13-14H,11-12,15-17H2,1-3H3