3-(3-propan-2-yloxyphenyl)-5-(3-propylphenyl)-1-prop-2-ynyl-piperidin-4-one

Systemtic Name: 3-(3-propan-2-yloxyphenyl)-5-(3-propylphenyl)-1-prop-2-ynyl-piperidin-4-one Openeye Name: 3-(3-isopropoxyphenyl)-5-(3-propylphenyl)-1-prop-2-ynyl-piperidin-4-one CAS Name: 3-(3-propan-2-yloxyphenyl)-5-(3-propylphenyl)-1-prop-2-ynyl-4-piperidinone IUPAC Name: 3-(3-propan-2-yloxyphenyl)-5-(3-propylphenyl)-1-prop-2-ynylpiperidin-4-one Traditional Name: 3-(3-isopropoxyphenyl)-1-propargyl-5-(3-propylphenyl)-4-piperidone Formula: C26H31NO2 MolecularWeight: 389.52984

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1)C2CN(CC(C2=O)C3=CC(=CC=C3)OC(C)C)CC#C

Isomeric SMILES

CCCC1=CC=CC(=C1)C2CN(CC(C2=O)C3=CC(=CC=C3)OC(C)C)CC#C

InChI

InChI=1S/C26H31NO2/c1-5-9-20-10-7-11-21(15-20)24-17-27(14-6-2)18-25(26(24)28)22-12-8-13-23(16-22)29-19(3)4/h2,7-8,10-13,15-16,19,24-25H,5,9,14,17-18H2,1,3-4H3