dimethyl-[2-[3-methyl-2-oxidanylidene-1-(phenylmethyl)indol-3-yl]oxyethyl]azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: dimethyl-[2-[3-methyl-2-oxidanylidene-1-(phenylmethyl)indol-3-yl]oxyethyl]azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: 2-(1-benzyl-3-methyl-2-oxo-indolin-3-yl)oxyethyl-dimethyl-ammonium; (Z)-4-hydroxy-4-oxo-but-2-enoate CAS Name: dimethyl-[2-[[3-methyl-2-oxo-1-(phenylmethyl)-3-indolyl]oxy]ethyl]ammonium; (Z)-4-hydroxy-4-oxo-2-butenoate IUPAC Name: 2-(1-benzyl-3-methyl-2-oxoindol-3-yl)oxyethyl-dimethylazanium; (Z)-4-hydroxy-4-oxobut-2-enoate Traditional Name: 2-(1-benzyl-2-keto-3-methyl-indolin-3-yl)oxyethyl-dimethyl-ammonium; (Z)-4-hydroxy-4-keto-but-2-enoate Formula: C24H28N2O6 MolecularWeight: 440.48892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)OCC[NH+](C)C.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)OCC[NH+](C)C.C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C20H24N2O2.C4H4O4/c1-20(24-14-13-21(2)3)17-11-7-8-12-18(17)22(19(20)23)15-16-9-5-4-6-10-16;5-3(6)1-2-4(7)8/h4-12H,13-15H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-