3-[4-(3-methylbut-2-enoxy)phenyl]-1-oxidanyl-4-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-[4-(3-methylbut-2-enoxy)phenyl]-1-oxidanyl-4-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 3-benzyl-1-hydroxy-4-[4-(3-methylbut-2-enoxy)phenyl]pyrrole-2,5-dione CAS Name: 1-hydroxy-3-[4-(3-methylbut-2-enoxy)phenyl]-4-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 3-benzyl-1-hydroxy-4-[4-(3-methylbut-2-enoxy)phenyl]pyrrole-2,5-dione Traditional Name: 3-benzyl-1-hydroxy-4-[4-(3-methylbut-2-enoxy)phenyl]-3-pyrroline-2,5-quinone Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=CC=C(C=C1)C2=C(C(=O)N(C2=O)O)CC3=CC=CC=C3)C

Isomeric SMILES

CC(=CCOC1=CC=C(C=C1)C2=C(C(=O)N(C2=O)O)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H21NO4/c1-15(2)12-13-27-18-10-8-17(9-11-18)20-19(21(24)23(26)22(20)25)14-16-6-4-3-5-7-16/h3-12,26H,13-14H2,1-2H3