[(2S)-2-(4-bromophenyl)-1-cyclohexyl-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-phenyl-methanolate

Systemtic Name: [(2S)-2-(4-bromophenyl)-1-cyclohexyl-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-phenyl-methanolate Openeye Name: [(2S)-2-(4-bromophenyl)-1-cyclohexyl-4,5-dioxo-pyrrolidin-3-ylidene]-phenyl-methanolate CAS Name: [(2S)-2-(4-bromophenyl)-1-cyclohexyl-4,5-dioxo-3-pyrrolidinylidene]-phenylmethanolate IUPAC Name: [(2S)-2-(4-bromophenyl)-1-cyclohexyl-4,5-dioxopyrrolidin-3-ylidene]-phenylmethanolate Traditional Name: [(2S)-2-(4-bromophenyl)-1-cyclohexyl-4,5-diketo-pyrrolidin-3-ylidene]-phenyl-methanolate Formula: C23H21BrNO3- MolecularWeight: 439.32174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(C(=C(C3=CC=CC=C3)[O-])C(=O)C2=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC(CC1)N2[C@H](C(=C(C3=CC=CC=C3)[O-])C(=O)C2=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H22BrNO3/c24-17-13-11-15(12-14-17)20-19(21(26)16-7-3-1-4-8-16)22(27)23(28)25(20)18-9-5-2-6-10-18/h1,3-4,7-8,11-14,18,20,26H,2,5-6,9-10H2/p-1/t20-/m0/s1