methyl 2-[4-[[4-butyl-1-[(4-hydroxyphenyl)methyl]-6-oxidanylidene-pyrimidin-5-yl]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[4-butyl-1-[(4-hydroxyphenyl)methyl]-6-oxidanylidene-pyrimidin-5-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[4-butyl-1-[(4-hydroxyphenyl)methyl]-6-oxo-pyrimidin-5-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[4-butyl-1-[(4-hydroxyphenyl)methyl]-6-oxo-5-pyrimidinyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[4-butyl-1-[(4-hydroxyphenyl)methyl]-6-oxopyrimidin-5-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[4-butyl-1-(4-hydroxybenzyl)-6-keto-pyrimidin-5-yl]methyl]phenyl]benzoic acid methyl ester Formula: C30H30N2O4 MolecularWeight: 482.5702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C=N1)CC2=CC=C(C=C2)O)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=O)N(C=N1)CC2=CC=C(C=C2)O)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C30H30N2O4/c1-3-4-9-28-27(29(34)32(20-31-28)19-22-12-16-24(33)17-13-22)18-21-10-14-23(15-11-21)25-7-5-6-8-26(25)30(35)36-2/h5-8,10-17,20,33H,3-4,9,18-19H2,1-2H3