(5S)-4-[(3-chloranyl-4-ethoxy-phenyl)-oxidanyl-methylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enyl-pyrrolidine-2,3-dione

Systemtic Name: (5S)-4-[(3-chloranyl-4-ethoxy-phenyl)-oxidanyl-methylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enyl-pyrrolidine-2,3-dione Openeye Name: (5S)-1-allyl-4-[(3-chloro-4-ethoxy-phenyl)-hydroxy-methylene]-5-(4-isopropylphenyl)pyrrolidine-2,3-dione CAS Name: (5S)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enylpyrrolidine-2,3-dione IUPAC Name: (5S)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-5-(4-propan-2-ylphenyl)-1-prop-2-enylpyrrolidine-2,3-dione Traditional Name: (5S)-1-allyl-4-[(3-chloro-4-ethoxy-phenyl)-hydroxy-methylene]-5-p-cumenyl-pyrrolidine-2,3-quinone Formula: C25H26ClNO4 MolecularWeight: 439.93124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CC=C)C3=CC=C(C=C3)C(C)C)O)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=C2[C@@H](N(C(=O)C2=O)CC=C)C3=CC=C(C=C3)C(C)C)O)Cl

InChI

InChI=1S/C25H26ClNO4/c1-5-13-27-22(17-9-7-16(8-10-17)15(3)4)21(24(29)25(27)30)23(28)18-11-12-20(31-6-2)19(26)14-18/h5,7-12,14-15,22,28H,1,6,13H2,2-4H3/t22-/m0/s1