N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methyl]piperidin-3-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methyl]piperidin-3-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methyl]piperidin-3-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[[4-methoxy-3-(1-pyrazolylmethyl)phenyl]methyl]-3-piperidinamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methyl]piperidin-3-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[4-methoxy-3-(pyrazol-1-ylmethyl)benzyl]-3-piperidyl]amine Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCC(C2)NC3=CC4=C(C=C3)OCCO4)CN5C=CC=N5

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCC(C2)NC3=CC4=C(C=C3)OCCO4)CN5C=CC=N5

InChI

InChI=1S/C25H30N4O3/c1-30-23-7-5-19(14-20(23)17-29-11-3-9-26-29)16-28-10-2-4-22(18-28)27-21-6-8-24-25(15-21)32-13-12-31-24/h3,5-9,11,14-15,22,27H,2,4,10,12-13,16-18H2,1H3