2-(3-ethoxy-2-oxidanylidene-3-phenyl-indol-1-yl)ethyl-diethyl-azanium; (E)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: 2-(3-ethoxy-2-oxidanylidene-3-phenyl-indol-1-yl)ethyl-diethyl-azanium; (E)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: 2-(3-ethoxy-2-oxo-3-phenyl-indolin-1-yl)ethyl-diethyl-ammonium; (E)-4-hydroxy-4-oxo-but-2-enoate CAS Name: 2-(3-ethoxy-2-oxo-3-phenyl-1-indolyl)ethyl-diethylammonium; (E)-4-hydroxy-4-oxo-2-butenoate IUPAC Name: 2-(3-ethoxy-2-oxo-3-phenylindol-1-yl)ethyl-diethylazanium; (E)-4-hydroxy-4-oxobut-2-enoate Traditional Name: 2-(3-ethoxy-2-keto-3-phenyl-indolin-1-yl)ethyl-diethyl-ammonium; (E)-4-hydroxy-4-keto-but-2-enoate Formula: C26H32N2O6 MolecularWeight: 468.54208

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2C(C1=O)(C3=CC=CC=C3)OCC.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2C(C1=O)(C3=CC=CC=C3)OCC.C(=C/C(=O)[O-])\C(=O)O

InChI

InChI=1S/C22H28N2O2.C4H4O4/c1-4-23(5-2)16-17-24-20-15-11-10-14-19(20)22(21(24)25,26-6-3)18-12-8-7-9-13-18;5-3(6)1-2-4(7)8/h7-15H,4-6,16-17H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+