2-methylpropyl 4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)amino]benzoate

Systemtic Name: 2-methylpropyl 4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)amino]benzoate Openeye Name: isobutyl 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]benzoate CAS Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)amino]benzoate Traditional Name: 4-[(4-keto-6-propyl-1H-pyrimidin-2-yl)amino]benzoic acid isobutyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)NC2=CC=C(C=C2)C(=O)OCC(C)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)NC2=CC=C(C=C2)C(=O)OCC(C)C

InChI

InChI=1S/C18H23N3O3/c1-4-5-15-10-16(22)21-18(20-15)19-14-8-6-13(7-9-14)17(23)24-11-12(2)3/h6-10,12H,4-5,11H2,1-3H3,(H2,19,20,21,22)