(2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(1-naphthylmethyl)piperazin-1-yl]propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(1-naphthalenylmethyl)-1-piperazinyl]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(1-naphthylmethyl)piperazino]propionamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H27N3O3/c1-18(25(29)26-21-9-10-23-24(15-21)31-17-30-23)28-13-11-27(12-14-28)16-20-7-4-6-19-5-2-3-8-22(19)20/h2-10,15,18H,11-14,16-17H2,1H3,(H,26,29)/t18-/m1/s1