[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-(2-pyrazol-1-ylphenyl)methanone

Systemtic Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-(2-pyrazol-1-ylphenyl)methanone Openeye Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]-(2-pyrazol-1-ylphenyl)methanone CAS Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinyl]-[2-(1-pyrazolyl)phenyl]methanone IUPAC Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-(2-pyrazol-1-ylphenyl)methanone Traditional Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidino]-(2-pyrazol-1-ylphenyl)methanone Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC=C2N3C=CC=N3)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC=CC=C2N3C=CC=N3)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H24N4O3/c28-23(19-6-1-2-7-20(19)27-12-4-10-24-27)26-11-3-5-18(16-26)25-17-8-9-21-22(15-17)30-14-13-29-21/h1-2,4,6-10,12,15,18,25H,3,5,11,13-14,16H2/t18-/m0/s1