1,3-benzodioxol-5-yl-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-3-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-3-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]-3-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(3-methyl-1-propyl-4-pyrazolyl)methyl]-3-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(3-methyl-1-propylpyrazol-4-yl)methyl]piperidin-3-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]-3-piperidyl]methanone Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)CN2CCCC(C2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN1C=C(C(=N1)C)CN2CCC[C@@H](C2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H27N3O3/c1-3-8-24-13-18(15(2)22-24)12-23-9-4-5-17(11-23)21(25)16-6-7-19-20(10-16)27-14-26-19/h6-7,10,13,17H,3-5,8-9,11-12,14H2,1-2H3/t17-/m0/s1