O2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl] O1-ethyl ethanedioate; 1H-indole

Systemtic Name: O2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl] O1-ethyl ethanedioate; 1H-indole Openeye Name: O2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl] O1-ethyl oxalate; indole CAS Name: 1H-indole; oxalic acid O2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl] ester O1-ethyl ester IUPAC Name: 2-O-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl] 1-O-ethyl oxalate; 1H-indole Traditional Name: indole; oxalic acid O2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino] ester O1-ethyl ester Formula: C24H27N3O6 MolecularWeight: 453.48768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)ON1CCN(CC1)C2=C3C(=CC=C2)OCCO3.C1=CC=C2C(=C1)C=CN2

Isomeric SMILES

CCOC(=O)C(=O)ON1CCN(CC1)C2=C3C(=CC=C2)OCCO3.C1=CC=C2C(=C1)C=CN2

InChI

InChI=1S/C16H20N2O6.C8H7N/c1-2-21-15(19)16(20)24-18-8-6-17(7-9-18)12-4-3-5-13-14(12)23-11-10-22-13;1-2-4-8-7(3-1)5-6-9-8/h3-5H,2,6-11H2,1H3;1-6,9H