ethyl 2-[6-[3-[4-(diphenylmethyl)oxypiperidin-1-yl]propoxy]-3-oxidanylidene-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[6-[3-[4-(diphenylmethyl)oxypiperidin-1-yl]propoxy]-3-oxidanylidene-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]ethanoate Openeye Name: ethyl 2-[6-[3-(4-benzhydryloxy-1-piperidyl)propoxy]-3-oxo-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]acetate CAS Name: 2-[6-[3-[4-(diphenylmethyl)oxy-1-piperidinyl]propoxy]-3-oxo-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[3-(4-benzhydryloxypiperidin-1-yl)propoxy]-3-oxo-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]acetate Traditional Name: 2-[6-[3-(4-benzhydryloxypiperidino)propoxy]-3-keto-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]acetic acid ethyl ester Formula: C30H35N5O5 MolecularWeight: 545.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)N2C(=N1)C=CC(=N2)OCCCN3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)CN1C(=O)N2C(=N1)C=CC(=N2)OCCCN3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N5O5/c1-2-38-28(36)22-34-30(37)35-26(31-34)14-15-27(32-35)39-21-9-18-33-19-16-25(17-20-33)40-29(23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-8,10-15,25,29H,2,9,16-22H2,1H3