6-[3-[1-(6-chloranylpyridazin-3-yl)piperidin-4-yl]propoxy]-3-ethoxy-1,2-benzoxazole

Systemtic Name: 6-[3-[1-(6-chloranylpyridazin-3-yl)piperidin-4-yl]propoxy]-3-ethoxy-1,2-benzoxazole Openeye Name: 6-[3-[1-(6-chloropyridazin-3-yl)-4-piperidyl]propoxy]-3-ethoxy-1,2-benzoxazole CAS Name: 6-[3-[1-(6-chloro-3-pyridazinyl)-4-piperidinyl]propoxy]-3-ethoxy-1,2-benzoxazole IUPAC Name: 6-[3-[1-(6-chloropyridazin-3-yl)piperidin-4-yl]propoxy]-3-ethoxy-1,2-benzoxazole Traditional Name: 6-[3-[1-(6-chloropyridazin-3-yl)-4-piperidyl]propoxy]-3-ethoxy-indoxazene Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NOC2=C1C=CC(=C2)OCCCC3CCN(CC3)C4=NN=C(C=C4)Cl

Isomeric SMILES

CCOC1=NOC2=C1C=CC(=C2)OCCCC3CCN(CC3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C21H25ClN4O3/c1-2-27-21-17-6-5-16(14-18(17)29-25-21)28-13-3-4-15-9-11-26(12-10-15)20-8-7-19(22)23-24-20/h5-8,14-15H,2-4,9-13H2,1H3