[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-[(4-propan-2-ylphenoxy)methyl]phenyl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-[(4-isopropylphenoxy)methyl]phenyl]-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [3-[(4-propan-2-ylphenoxy)methyl]phenyl]-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: [3-[(4-propan-2-ylphenoxy)methyl]phenyl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [3-[(4-isopropylphenoxy)methyl]phenyl]-[4-(3-pyridylmethyl)piperazino]methanone Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-21(2)24-8-10-26(11-9-24)32-20-22-5-3-7-25(17-22)27(31)30-15-13-29(14-16-30)19-23-6-4-12-28-18-23/h3-12,17-18,21H,13-16,19-20H2,1-2H3