1-[(3R,5S)-5-methyl-2,4-bis(oxidanylidene)oxolan-3-yl]ethylidene-(phenylmethyl)azanium

Systemtic Name: 1-[(3R,5S)-5-methyl-2,4-bis(oxidanylidene)oxolan-3-yl]ethylidene-(phenylmethyl)azanium Openeye Name: benzyl-[1-[(3R,5S)-5-methyl-2,4-dioxo-tetrahydrofuran-3-yl]ethylidene]ammonium CAS Name: 1-[(3R,5S)-5-methyl-2,4-dioxo-3-oxolanyl]ethylidene-(phenylmethyl)ammonium IUPAC Name: benzyl-[1-[(3R,5S)-5-methyl-2,4-dioxooxolan-3-yl]ethylidene]azanium Traditional Name: benzyl-[1-[(3R,5S)-2,4-diketo-5-methyl-tetrahydrofuran-3-yl]ethylidene]ammonium Formula: C14H16NO3+ MolecularWeight: 246.28174

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C(C(=O)O1)C(=[NH+]CC2=CC=CC=C2)C

Isomeric SMILES

C[C@H]1C(=O)[C@H](C(=O)O1)C(=[NH+]CC2=CC=CC=C2)C

InChI

InChI=1S/C14H15NO3/c1-9(12-13(16)10(2)18-14(12)17)15-8-11-6-4-3-5-7-11/h3-7,10,12H,8H2,1-2H3/p+1/t10-,12+/m0/s1