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

Systemtic Name: methyl 4-phenoxy-3-phenyl-4-(4-pyridin-4-ylpiperazin-1-yl)butanoate Openeye Name: methyl 4-phenoxy-3-phenyl-4-[4-(4-pyridyl)piperazin-1-yl]butanoate CAS Name: 4-phenoxy-3-phenyl-4-(4-pyridin-4-yl-1-piperazinyl)butanoic acid methyl ester IUPAC Name: methyl 4-phenoxy-3-phenyl-4-(4-pyridin-4-ylpiperazin-1-yl)butanoate Traditional Name: 4-phenoxy-3-phenyl-4-[4-(4-pyridyl)piperazino]butyric acid methyl ester Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)C(N2CCN(CC2)C3=CC=NC=C3)OC4=CC=CC=C4

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)C(N2CCN(CC2)C3=CC=NC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3/c1-31-25(30)20-24(21-8-4-2-5-9-21)26(32-23-10-6-3-7-11-23)29-18-16-28(17-19-29)22-12-14-27-15-13-22/h2-15,24,26H,16-20H2,1H3