[4-(3-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone

Systemtic Name: [4-(3-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone Openeye Name: [4-(3-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(4-pyridylmethoxy)phenyl]methanone CAS Name: [4-(3-chlorophenyl)-1-piperazinyl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone IUPAC Name: [4-(3-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone Traditional Name: [4-(3-chlorophenyl)piperazino]-[3-ethoxy-4-(4-pyridylmethoxy)phenyl]methanone Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)OCC4=CC=NC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)OCC4=CC=NC=C4

InChI

InChI=1S/C25H26ClN3O3/c1-2-31-24-16-20(6-7-23(24)32-18-19-8-10-27-11-9-19)25(30)29-14-12-28(13-15-29)22-5-3-4-21(26)17-22/h3-11,16-17H,2,12-15,18H2,1H3