(4E)-1-(2-dimethylaminoethyl)-4-[(3-methyl-4-phenylmethoxy-phenyl)-oxidanyl-methylidene]-5-pyridin-3-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-(2-dimethylaminoethyl)-4-[(3-methyl-4-phenylmethoxy-phenyl)-oxidanyl-methylidene]-5-pyridin-3-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(4-benzyloxy-3-methyl-phenyl)-hydroxy-methylene]-1-(2-dimethylaminoethyl)-5-(3-pyridyl)pyrrolidine-2,3-dione CAS Name: (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-5-(3-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-(3-methyl-4-phenylmethoxyphenyl)methylidene]-5-pyridin-3-ylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(4-benzoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(2-dimethylaminoethyl)-5-(3-pyridyl)pyrrolidine-2,3-quinone Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CN=CC=C3)O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCN(C)C)C3=CN=CC=C3)/O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O4/c1-19-16-21(11-12-23(19)35-18-20-8-5-4-6-9-20)26(32)24-25(22-10-7-13-29-17-22)31(15-14-30(2)3)28(34)27(24)33/h4-13,16-17,25,32H,14-15,18H2,1-3H3/b26-24+