(4-propan-2-yloxyphenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone hydrochloride

Systemtic Name: (4-propan-2-yloxyphenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone hydrochloride Openeye Name: (4-isopropoxyphenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone hydrochloride CAS Name: (4-propan-2-yloxyphenyl)-[4-(6-propoxy-3-pyridazinyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: (4-propan-2-yloxyphenyl)-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]methanone hydrochloride Traditional Name: (4-isopropoxyphenyl)-[4-(6-propoxypyridazin-3-yl)piperazino]methanone hydrochloride Formula: C21H29ClN4O3 MolecularWeight: 420.93296

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC(C)C.Cl

Isomeric SMILES

CCCOC1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC(C)C.Cl

InChI

InChI=1S/C21H28N4O3.ClH/c1-4-15-27-20-10-9-19(22-23-20)24-11-13-25(14-12-24)21(26)17-5-7-18(8-6-17)28-16(2)3;/h5-10,16H,4,11-15H2,1-3H3;1H