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

Systemtic Name: 3-(3-ethoxy-2-oxidanylidene-3-phenyl-indol-1-yl)propyl-diethyl-azanium; (E)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: 3-(3-ethoxy-2-oxo-3-phenyl-indolin-1-yl)propyl-diethyl-ammonium; (E)-4-hydroxy-4-oxo-but-2-enoate CAS Name: 3-(3-ethoxy-2-oxo-3-phenyl-1-indolyl)propyl-diethylammonium; (E)-4-hydroxy-4-oxo-2-butenoate IUPAC Name: 3-(3-ethoxy-2-oxo-3-phenylindol-1-yl)propyl-diethylazanium; (E)-4-hydroxy-4-oxobut-2-enoate Traditional Name: 3-(3-ethoxy-2-keto-3-phenyl-indolin-1-yl)propyl-diethyl-ammonium; (E)-4-hydroxy-4-keto-but-2-enoate Formula: C27H34N2O6 MolecularWeight: 482.56866

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C2=CC=CC=C2C(C1=O)(C3=CC=CC=C3)OCC.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

CC[NH+](CC)CCCN1C2=CC=CC=C2C(C1=O)(C3=CC=CC=C3)OCC.C(=C/C(=O)[O-])\C(=O)O

InChI

InChI=1S/C23H30N2O2.C4H4O4/c1-4-24(5-2)17-12-18-25-21-16-11-10-15-20(21)23(22(25)26,27-6-3)19-13-8-7-9-14-19;5-3(6)1-2-4(7)8/h7-11,13-16H,4-6,12,17-18H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+