[6-[4-(6-azanylpyridazin-3-yl)oxypiperidin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone; ethanoic acid

Systemtic Name: [6-[4-(6-azanylpyridazin-3-yl)oxypiperidin-1-yl]pyridin-3-yl]-pyrrolidin-1-yl-methanone; ethanoic acid Openeye Name: acetic acid; [6-[4-(6-aminopyridazin-3-yl)oxy-1-piperidyl]-3-pyridyl]-pyrrolidin-1-yl-methanone CAS Name: acetic acid; [6-[4-[(6-amino-3-pyridazinyl)oxy]-1-piperidinyl]-3-pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: acetic acid; [6-[4-(6-aminopyridazin-3-yl)oxypiperidin-1-yl]pyridin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: acetic acid; [6-[4-(6-aminopyridazin-3-yl)oxypiperidino]-3-pyridyl]-pyrrolidino-methanone Formula: C21H28N6O4 MolecularWeight: 428.48482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CCN(C1)C(=O)C2=CN=C(C=C2)N3CCC(CC3)OC4=NN=C(C=C4)N

Isomeric SMILES

CC(=O)O.C1CCN(C1)C(=O)C2=CN=C(C=C2)N3CCC(CC3)OC4=NN=C(C=C4)N

InChI

InChI=1S/C19H24N6O2.C2H4O2/c20-16-4-6-18(23-22-16)27-15-7-11-24(12-8-15)17-5-3-14(13-21-17)19(26)25-9-1-2-10-25;1-2(3)4/h3-6,13,15H,1-2,7-12H2,(H2,20,22);1H3,(H,3,4)