1-[3-bromanyl-5-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]phenyl]-3-methyl-pyrrole-2,5-dione

Systemtic Name: 1-[3-bromanyl-5-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]phenyl]-3-methyl-pyrrole-2,5-dione Openeye Name: 1-[3-bromo-5-(3-methyl-2,5-dioxo-pyrrol-1-yl)phenyl]-3-methyl-pyrrole-2,5-dione CAS Name: 1-[3-bromo-5-(3-methyl-2,5-dioxo-1-pyrrolyl)phenyl]-3-methylpyrrole-2,5-dione IUPAC Name: 1-[3-bromo-5-(3-methyl-2,5-dioxopyrrol-1-yl)phenyl]-3-methylpyrrole-2,5-dione Traditional Name: 1-(3-bromo-5-citraconimido-phenyl)-3-methyl-3-pyrroline-2,5-quinone Formula: C16H11BrN2O4 MolecularWeight: 375.17354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)C2=CC(=CC(=C2)Br)N3C(=O)C=C(C3=O)C

Isomeric SMILES

CC1=CC(=O)N(C1=O)C2=CC(=CC(=C2)Br)N3C(=O)C=C(C3=O)C

InChI

InChI=1S/C16H11BrN2O4/c1-8-3-13(20)18(15(8)22)11-5-10(17)6-12(7-11)19-14(21)4-9(2)16(19)23/h3-7H,1-2H3