3-[2-(hydroxymethyl)hept-6-enoyl]-3-(phenylmethyl)-1,3-oxazolidin-3-ium-2-one

Systemtic Name: 3-[2-(hydroxymethyl)hept-6-enoyl]-3-(phenylmethyl)-1,3-oxazolidin-3-ium-2-one Openeye Name: 3-benzyl-3-[2-(hydroxymethyl)hept-6-enoyl]oxazolidin-3-ium-2-one CAS Name: 3-[2-(hydroxymethyl)-1-oxohept-6-enyl]-3-(phenylmethyl)-2-oxazolidin-3-iumone IUPAC Name: 3-benzyl-3-[2-(hydroxymethyl)hept-6-enoyl]-1,3-oxazolidin-3-ium-2-one Traditional Name: 3-benzyl-3-(2-methylolhept-6-enoyl)oxazolidin-3-ium-2-one Formula: C18H24NO4+ MolecularWeight: 318.38746

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC(CO)C(=O)[N+]1(CCOC1=O)CC2=CC=CC=C2

Isomeric SMILES

C=CCCCC(CO)C(=O)[N+]1(CCOC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H24NO4/c1-2-3-5-10-16(14-20)17(21)19(11-12-23-18(19)22)13-15-8-6-4-7-9-15/h2,4,6-9,16,20H,1,3,5,10-14H2/q+1