methyl-[2-(2-methyl-5,6,7,8-tetrahydroindolizin-3-yl)ethyl]azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl-[2-(2-methyl-5,6,7,8-tetrahydroindolizin-3-yl)ethyl]azanium; (Z)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: (Z)-4-hydroxy-4-oxo-but-2-enoate; methyl-[2-(2-methyl-5,6,7,8-tetrahydroindolizin-3-yl)ethyl]ammonium CAS Name: (Z)-4-hydroxy-4-oxo-2-butenoate; methyl-[2-(2-methyl-5,6,7,8-tetrahydroindolizin-3-yl)ethyl]ammonium IUPAC Name: (Z)-4-hydroxy-4-oxobut-2-enoate; methyl-[2-(2-methyl-5,6,7,8-tetrahydroindolizin-3-yl)ethyl]azanium Traditional Name: (Z)-4-hydroxy-4-keto-but-2-enoate; methyl-[2-(2-methyl-5,6,7,8-tetrahydroindolizin-3-yl)ethyl]ammonium Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2CCCCC2=C1)CC[NH2+]C.C(=CC(=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(N2CCCCC2=C1)CC[NH2+]C.C(=C\C(=O)[O-])\C(=O)O

InChI

InChI=1S/C12H20N2.C4H4O4/c1-10-9-11-5-3-4-8-14(11)12(10)6-7-13-2;5-3(6)1-2-4(7)8/h9,13H,3-8H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-