[4-(2-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone

Systemtic Name: [4-(2-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone Openeye Name: [4-(2-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(4-pyridylmethoxy)phenyl]methanone CAS Name: [4-(2-chlorophenyl)-1-piperazinyl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone IUPAC Name: [4-(2-chlorophenyl)piperazin-1-yl]-[3-ethoxy-4-(pyridin-4-ylmethoxy)phenyl]methanone Traditional Name: [4-(2-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=C3Cl)OCC4=CC=NC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3Cl)OCC4=CC=NC=C4

InChI

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