(phenylmethyl) 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]piperazine-1-carboxylate Openeye Name: benzyl 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]piperazine-1-carboxylate CAS Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-oxomethyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]piperazine-1-carboxylate Traditional Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]piperazine-1-carboxylic acid benzyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C(=O)NCCC2=CC3=C(C=C2)OCCO3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC(N1)C(=O)NCCC2=CC3=C(C=C2)OCCO3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O5/c27-22(25-9-8-17-6-7-20-21(14-17)30-13-12-29-20)19-15-26(11-10-24-19)23(28)31-16-18-4-2-1-3-5-18/h1-7,14,19,24H,8-13,15-16H2,(H,25,27)