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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

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