2-[3-(hydroxymethyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-yl]propanedioate

Systemtic Name: 2-[3-(hydroxymethyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-yl]propanedioate Openeye Name: 2-[3-(hydroxymethyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-yl]propanedioate CAS Name: 2-[3-(hydroxymethyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-yl]propanedioate IUPAC Name: 2-[3-(hydroxymethyl)-6,11-dihydrobenzo[c][1]benzoxepin-11-yl]propanedioate Traditional Name: 2-(3-methylol-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)malonate Formula: C18H14O6-2 MolecularWeight: 326.30016

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(C3=C(O1)C=C(C=C3)CO)C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2C(C3=C(O1)C=C(C=C3)CO)C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H16O6/c19-8-10-5-6-13-14(7-10)24-9-11-3-1-2-4-12(11)15(13)16(17(20)21)18(22)23/h1-7,15-16,19H,8-9H2,(H,20,21)(H,22,23)/p-2