methyl 5-[2-(1H-indol-3-yl)ethanoyloxymethyl]-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate

Systemtic Name: methyl 5-[2-(1H-indol-3-yl)ethanoyloxymethyl]-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate Openeye Name: methyl 5-[[2-(1H-indol-3-yl)acetyl]oxymethyl]-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate CAS Name: 5-[[2-(1H-indol-3-yl)-1-oxoethoxy]methyl]-2,3,4,7-tetrahydro-1H-azepine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(1H-indol-3-yl)acetyl]oxymethyl]-2,3,4,7-tetrahydro-1H-azepine-3-carboxylate Traditional Name: 5-[[2-(1H-indol-3-yl)acetyl]oxymethyl]-2,3,4,7-tetrahydro-1H-azepine-3-carboxylic acid methyl ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=CCNC1)COC(=O)CC2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1CC(=CCNC1)COC(=O)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C19H22N2O4/c1-24-19(23)15-8-13(6-7-20-10-15)12-25-18(22)9-14-11-21-17-5-3-2-4-16(14)17/h2-6,11,15,20-21H,7-10,12H2,1H3