ethyl 4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-6-(4-methylphenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-6-(4-methylphenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-4-[(4-ethoxycarbonyl-1-piperidyl)methyl]-2-oxo-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[(4-ethoxycarbonyl-1-piperidinyl)methyl]-6-(4-methylphenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxycarbonylpiperidin-1-yl)methyl]-6-(4-methylphenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-4-[(4-carbethoxypiperidino)methyl]-2-keto-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H35N3O5 MolecularWeight: 469.5732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=C(C(NC(=O)N2CC=C)C3=CC=C(C=C3)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=C(C(NC(=O)N2CC=C)C3=CC=C(C=C3)C)C(=O)OCC

InChI

InChI=1S/C26H35N3O5/c1-5-14-29-21(17-28-15-12-20(13-16-28)24(30)33-6-2)22(25(31)34-7-3)23(27-26(29)32)19-10-8-18(4)9-11-19/h5,8-11,20,23H,1,6-7,12-17H2,2-4H3,(H,27,32)