[4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-(pyridin-3-ylmethoxy)phenyl]methanone

Systemtic Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-(pyridin-3-ylmethoxy)phenyl]methanone Openeye Name: [4-(m-tolylmethyl)piperazin-1-yl]-[4-(3-pyridylmethoxy)phenyl]methanone CAS Name: [4-[(3-methylphenyl)methyl]-1-piperazinyl]-[4-(3-pyridinylmethoxy)phenyl]methanone IUPAC Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-[4-(pyridin-3-ylmethoxy)phenyl]methanone Traditional Name: [4-(3-methylbenzyl)piperazino]-[4-(3-pyridylmethoxy)phenyl]methanone Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-20-4-2-5-21(16-20)18-27-12-14-28(15-13-27)25(29)23-7-9-24(10-8-23)30-19-22-6-3-11-26-17-22/h2-11,16-17H,12-15,18-19H2,1H3