2-acetyloxybenzoic acid; 5-(2-methylpropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 2-acetyloxybenzoic acid; 5-(2-methylpropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione Openeye Name: 2-acetoxybenzoic acid; 5-allyl-5-isobutyl-hexahydropyrimidine-2,4,6-trione CAS Name: 2-acetyloxybenzoic acid; 5-(2-methylpropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione IUPAC Name: 2-acetyloxybenzoic acid; 5-(2-methylpropyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione Traditional Name: 2-acetoxybenzoic acid; 5-allyl-5-isobutyl-barbituric acid Formula: C20H24N2O7 MolecularWeight: 404.41376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C(=O)NC(=O)NC1=O)CC=C.CC(=O)OC1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)CC1(C(=O)NC(=O)NC1=O)CC=C.CC(=O)OC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C11H16N2O3.C9H8O4/c1-4-5-11(6-7(2)3)8(14)12-10(16)13-9(11)15;1-6(10)13-8-5-3-2-4-7(8)9(11)12/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16);2-5H,1H3,(H,11,12)