2,3-dihydro-1,4-benzodioxin-5-yl-[4-[(4-methylphenyl)-phenyl-methyl]piperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-5-yl-[4-[(4-methylphenyl)-phenyl-methyl]piperazin-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-5-yl-[4-[phenyl(p-tolyl)methyl]piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-5-yl-[4-[(4-methylphenyl)-phenylmethyl]-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-5-yl-[4-[(4-methylphenyl)-phenylmethyl]piperazin-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-5-yl-[4-[phenyl(p-tolyl)methyl]piperazino]methanone Formula: C27H28N2O3 MolecularWeight: 428.52282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(CC3)C(=O)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(CC3)C(=O)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C27H28N2O3/c1-20-10-12-22(13-11-20)25(21-6-3-2-4-7-21)28-14-16-29(17-15-28)27(30)23-8-5-9-24-26(23)32-19-18-31-24/h2-13,25H,14-19H2,1H3