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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-[(3-ethoxycarbonylpiperidin-1-yl)methyl]-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-6-(4-tert-butylphenyl)-4-[(3-ethoxycarbonyl-1-piperidyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-[(3-ethoxycarbonyl-1-piperidinyl)methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-[(3-ethoxycarbonylpiperidin-1-yl)methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-6-(4-tert-butylphenyl)-4-[(3-carbethoxypiperidino)methyl]-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H41N3O5 MolecularWeight: 511.65294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=C(C(NC(=O)N2CC=C)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=C(C(NC(=O)N2CC=C)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C29H41N3O5/c1-7-16-32-23(19-31-17-10-11-21(18-31)26(33)36-8-2)24(27(34)37-9-3)25(30-28(32)35)20-12-14-22(15-13-20)29(4,5)6/h7,12-15,21,25H,1,8-11,16-19H2,2-6H3,(H,30,35)