ethyl 3-methyl-4-phenoxy-4-(4-pyridin-4-ylpiperazin-1-yl)butanoate

Systemtic Name: ethyl 3-methyl-4-phenoxy-4-(4-pyridin-4-ylpiperazin-1-yl)butanoate Openeye Name: ethyl 3-methyl-4-phenoxy-4-[4-(4-pyridyl)piperazin-1-yl]butanoate CAS Name: 3-methyl-4-phenoxy-4-(4-pyridin-4-yl-1-piperazinyl)butanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-phenoxy-4-(4-pyridin-4-ylpiperazin-1-yl)butanoate Traditional Name: 3-methyl-4-phenoxy-4-[4-(4-pyridyl)piperazino]butyric acid ethyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)C(N1CCN(CC1)C2=CC=NC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(C)C(N1CCN(CC1)C2=CC=NC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3/c1-3-27-21(26)17-18(2)22(28-20-7-5-4-6-8-20)25-15-13-24(14-16-25)19-9-11-23-12-10-19/h4-12,18,22H,3,13-17H2,1-2H3