6-[(5S)-5-(4-bromophenyl)pyrazolidin-3-ylidene]-3,4,7-trimethyl-chromene-2,5-dione

Systemtic Name: 6-[(5S)-5-(4-bromophenyl)pyrazolidin-3-ylidene]-3,4,7-trimethyl-chromene-2,5-dione Openeye Name: 6-[(5S)-5-(4-bromophenyl)pyrazolidin-3-ylidene]-3,4,7-trimethyl-chromene-2,5-dione CAS Name: 6-[(5S)-5-(4-bromophenyl)-3-pyrazolidinylidene]-3,4,7-trimethyl-1-benzopyran-2,5-dione IUPAC Name: 6-[(5S)-5-(4-bromophenyl)pyrazolidin-3-ylidene]-3,4,7-trimethylchromene-2,5-dione Traditional Name: 6-[(5S)-5-(4-bromophenyl)pyrazolidin-3-ylidene]-3,4,7-trimethyl-chromene-2,5-quinone Formula: C21H19BrN2O3 MolecularWeight: 427.29116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=O)C1=C3CC(NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=O)C1=C3C[C@H](NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN2O3/c1-10-8-17-19(11(2)12(3)21(26)27-17)20(25)18(10)16-9-15(23-24-16)13-4-6-14(22)7-5-13/h4-8,15,23-24H,9H2,1-3H3/t15-/m0/s1