[4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone

Systemtic Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Openeye Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone CAS Name: [4-(6-cyclohexyloxy-3-pyridazinyl)-1-piperazinyl]-(3,4,5-triethoxyphenyl)methanone IUPAC Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Traditional Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazino]-(3,4,5-triethoxyphenyl)methanone Formula: C27H38N4O5 MolecularWeight: 498.61442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=NN=C(C=C3)OC4CCCCC4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=NN=C(C=C3)OC4CCCCC4

InChI

InChI=1S/C27H38N4O5/c1-4-33-22-18-20(19-23(34-5-2)26(22)35-6-3)27(32)31-16-14-30(15-17-31)24-12-13-25(29-28-24)36-21-10-8-7-9-11-21/h12-13,18-19,21H,4-11,14-17H2,1-3H3