1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)piperazin-1-yl]piperidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)piperazin-1-yl]piperidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)piperazin-1-yl]-1-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1-piperazinyl]-1-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)piperazin-1-yl]piperidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)piperazino]piperidino]methanone Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC3=C(C=C2)OCO3)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C23H26ClN3O3/c24-18-3-1-4-19(14-18)25-9-11-26(12-10-25)20-5-2-8-27(15-20)23(28)17-6-7-21-22(13-17)30-16-29-21/h1,3-4,6-7,13-14,20H,2,5,8-12,15-16H2/t20-/m0/s1