2-[4-(2-chlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol

Systemtic Name: 2-[4-(2-chlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol Openeye Name: 2-[4-(2-chlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol CAS Name: 2-[4-(2-chlorophenyl)-1-piperazinyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol IUPAC Name: 2-[4-(2-chlorophenyl)piperazin-1-yl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol Traditional Name: 2-[4-(2-chlorophenyl)piperazino]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(CN3CCN(CC3)C4=CC=CC=C4Cl)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(CN3CCN(CC3)C4=CC=CC=C4Cl)O)OC1

InChI

InChI=1S/C21H25ClN2O3/c22-17-4-1-2-5-18(17)24-10-8-23(9-11-24)15-19(25)16-6-7-20-21(14-16)27-13-3-12-26-20/h1-2,4-7,14,19,25H,3,8-13,15H2