5-[5-(3,4-dimethoxyphenyl)pent-4-ynyl]-1-(phenylmethyl)-3,4-dihydropyridin-2-one

Systemtic Name: 5-[5-(3,4-dimethoxyphenyl)pent-4-ynyl]-1-(phenylmethyl)-3,4-dihydropyridin-2-one Openeye Name: 1-benzyl-5-[5-(3,4-dimethoxyphenyl)pent-4-ynyl]-3,4-dihydropyridin-2-one CAS Name: 5-[5-(3,4-dimethoxyphenyl)pent-4-ynyl]-1-(phenylmethyl)-3,4-dihydropyridin-2-one IUPAC Name: 1-benzyl-5-[5-(3,4-dimethoxyphenyl)pent-4-ynyl]-3,4-dihydropyridin-2-one Traditional Name: 1-benzyl-5-[5-(3,4-dimethoxyphenyl)pent-4-ynyl]-3,4-dihydropyridin-2-one Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C#CCCCC2=CN(C(=O)CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C#CCCCC2=CN(C(=O)CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C25H27NO3/c1-28-23-15-13-20(17-24(23)29-2)9-5-3-8-12-22-14-16-25(27)26(19-22)18-21-10-6-4-7-11-21/h4,6-7,10-11,13,15,17,19H,3,8,12,14,16,18H2,1-2H3