methyl (3S)-5-(2-ethoxy-2-oxidanylidene-ethyl)-3-(hydroxymethyl)-1-oxidanylidene-2H-benzo[e]isoindole-3-carboxylate

Systemtic Name: methyl (3S)-5-(2-ethoxy-2-oxidanylidene-ethyl)-3-(hydroxymethyl)-1-oxidanylidene-2H-benzo[e]isoindole-3-carboxylate Openeye Name: methyl (3S)-5-(2-ethoxy-2-oxo-ethyl)-3-(hydroxymethyl)-1-oxo-2H-benzo[e]isoindole-3-carboxylate CAS Name: (3S)-5-(2-ethoxy-2-oxoethyl)-3-(hydroxymethyl)-1-oxo-2H-benzo[e]isoindole-3-carboxylic acid methyl ester IUPAC Name: methyl (3S)-5-(2-ethoxy-2-oxoethyl)-3-(hydroxymethyl)-1-oxo-2H-benzo[e]isoindole-3-carboxylate Traditional Name: (3S)-5-(2-ethoxy-2-keto-ethyl)-1-keto-3-methylol-2H-benz[e]isoindole-3-carboxylic acid methyl ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC2=C(C3=CC=CC=C31)C(=O)NC2(CO)C(=O)OC

Isomeric SMILES

CCOC(=O)CC1=CC2=C(C3=CC=CC=C31)C(=O)N[C@@]2(CO)C(=O)OC

InChI

InChI=1S/C19H19NO6/c1-3-26-15(22)9-11-8-14-16(13-7-5-4-6-12(11)13)17(23)20-19(14,10-21)18(24)25-2/h4-8,21H,3,9-10H2,1-2H3,(H,20,23)/t19-/m1/s1