2-[4-[[[(3S)-6-chloranyl-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]piperidin-1-yl]phenol

Systemtic Name: 2-[4-[[[(3S)-6-chloranyl-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]piperidin-1-yl]phenol Openeye Name: 2-[4-[[[(3S)-6-chloro-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]-1-piperidyl]phenol CAS Name: 2-[4-[[[(3S)-6-chloro-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]-1-piperidinyl]phenol IUPAC Name: 2-[4-[[[(3S)-6-chloro-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]piperidin-1-yl]phenol Traditional Name: 2-[4-[[[(3S)-6-chloro-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]piperidino]phenol Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNCC2COC3=C(O2)C=C(C=C3)Cl)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CCC1CNC[C@H]2COC3=C(O2)C=C(C=C3)Cl)C4=CC=CC=C4O

InChI

InChI=1S/C21H25ClN2O3/c22-16-5-6-20-21(11-16)27-17(14-26-20)13-23-12-15-7-9-24(10-8-15)18-3-1-2-4-19(18)25/h1-6,11,15,17,23,25H,7-10,12-14H2/t17-/m0/s1