3-[(3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylidene]-4-oxidanylidene-piperidin-1-yl]propyl-ethoxy-phosphinic acid

Systemtic Name: 3-[(3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylidene]-4-oxidanylidene-piperidin-1-yl]propyl-ethoxy-phosphinic acid Openeye Name: 3-[(3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylene]-4-oxo-1-piperidyl]propyl-ethoxy-phosphinic acid CAS Name: 3-[(3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylidene]-4-oxo-1-piperidinyl]propyl-ethoxyphosphinic acid IUPAC Name: 3-[(3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylidene]-4-oxopiperidin-1-yl]propyl-ethoxyphosphinic acid Traditional Name: 3-[(3E,5E)-3,5-bis[4-(dimethylamino)benzylidene]-4-keto-piperidino]propyl-ethoxy-phosphinic acid Formula: C28H38N3O4P MolecularWeight: 511.592781

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCN1CC(=CC2=CC=C(C=C2)N(C)C)C(=O)C(=CC3=CC=C(C=C3)N(C)C)C1)O

Isomeric SMILES

CCOP(=O)(O)CCCN1C/C(=C\C2=CC=C(C=C2)N(C)C)/C(=O)/C(=C/C3=CC=C(C=C3)N(C)C)/C1

InChI

InChI=1S/C28H38N3O4P/c1-6-35-36(33,34)17-7-16-31-20-24(18-22-8-12-26(13-9-22)29(2)3)28(32)25(21-31)19-23-10-14-27(15-11-23)30(4)5/h8-15,18-19H,6-7,16-17,20-21H2,1-5H3,(H,33,34)/b24-18+,25-19+