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

Systemtic Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-(1H-indazol-3-yl)methanone Openeye Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]-(1H-indazol-3-yl)methanone CAS Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinyl]-(1H-indazol-3-yl)methanone IUPAC Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-(1H-indazol-3-yl)methanone Traditional Name: [(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidino]-(1H-indazol-3-yl)methanone Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=NNC3=CC=CC=C32)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=NNC3=CC=CC=C32)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H22N4O3/c26-21(20-16-5-1-2-6-17(16)23-24-20)25-9-3-4-15(13-25)22-14-7-8-18-19(12-14)28-11-10-27-18/h1-2,5-8,12,15,22H,3-4,9-11,13H2,(H,23,24)/t15-/m0/s1