8-(4-prop-2-enoylphenyl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(4-prop-2-enoylphenyl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(4-prop-2-enoylphenyl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[4-(1-oxoprop-2-enyl)phenyl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(4-prop-2-enoylphenyl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(4-acryloylphenyl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)C(=O)C=C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)C(=O)C=C

InChI

InChI=1S/C20H22N4O3/c1-4-11-23-18-16(19(26)24(12-5-2)20(23)27)21-17(22-18)14-9-7-13(8-10-14)15(25)6-3/h6-10H,3-5,11-12H2,1-2H3,(H,21,22)