[1-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone

Systemtic Name: [1-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone Openeye Name: (3-isopropoxyphenyl)-[1-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]-3-piperidyl]methanone CAS Name: [1-[[2-(4-methoxyphenyl)-5-pyrimidinyl]methyl]-3-piperidinyl]-(3-propan-2-yloxyphenyl)methanone IUPAC Name: [1-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone Traditional Name: (3-isopropoxyphenyl)-[1-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]-3-piperidyl]methanone Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C2CCCN(C2)CC3=CN=C(N=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)C2CCCN(C2)CC3=CN=C(N=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H31N3O3/c1-19(2)33-25-8-4-6-22(14-25)26(31)23-7-5-13-30(18-23)17-20-15-28-27(29-16-20)21-9-11-24(32-3)12-10-21/h4,6,8-12,14-16,19,23H,5,7,13,17-18H2,1-3H3