dimethyl-[2-[(E)-oct-1-enyl]-3-oxidanyl-4,7-bis(oxidanylidene)oxepan-2-yl]-prop-2-enyl-azanium

Systemtic Name: dimethyl-[2-[(E)-oct-1-enyl]-3-oxidanyl-4,7-bis(oxidanylidene)oxepan-2-yl]-prop-2-enyl-azanium Openeye Name: allyl-[3-hydroxy-2-[(E)-oct-1-enyl]-4,7-dioxo-oxepan-2-yl]-dimethyl-ammonium CAS Name: [3-hydroxy-2-[(E)-oct-1-enyl]-4,7-dioxo-2-oxepanyl]-dimethyl-prop-2-enylammonium IUPAC Name: [3-hydroxy-2-[(E)-oct-1-enyl]-4,7-dioxooxepan-2-yl]-dimethyl-prop-2-enylazanium Traditional Name: allyl-[3-hydroxy-4,7-diketo-2-[(E)-oct-1-enyl]oxepan-2-yl]-dimethyl-ammonium Formula: C19H32NO4+ MolecularWeight: 338.46168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1(C(C(=O)CCC(=O)O1)O)[N+](C)(C)CC=C

Isomeric SMILES

CCCCCC/C=C/C1(C(C(=O)CCC(=O)O1)O)[N+](C)(C)CC=C

InChI

InChI=1S/C19H32NO4/c1-5-7-8-9-10-11-14-19(20(3,4)15-6-2)18(23)16(21)12-13-17(22)24-19/h6,11,14,18,23H,2,5,7-10,12-13,15H2,1,3-4H3/q+1/b14-11+