1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[[(1S)-1-naphthalen-2-ylethyl]amino]ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[[(1S)-1-naphthalen-2-ylethyl]amino]ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[[(1S)-1-(2-naphthyl)ethyl]amino]ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-[[(1S)-1-(2-naphthalenyl)ethyl]amino]ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[[(1S)-1-naphthalen-2-ylethyl]amino]ethanone Traditional Name: 2-[[(1S)-1-(2-naphthyl)ethyl]amino]-1-(4-piperonylpiperazino)ethanone Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C[C@@H](C1=CC2=CC=CC=C2C=C1)NCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H29N3O3/c1-19(22-8-7-21-4-2-3-5-23(21)15-22)27-16-26(30)29-12-10-28(11-13-29)17-20-6-9-24-25(14-20)32-18-31-24/h2-9,14-15,19,27H,10-13,16-18H2,1H3/t19-/m0/s1