ethyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate

Systemtic Name: ethyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate Openeye Name: ethyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate CAS Name: 5-(hydroxymethyl)-3-[[2-(1H-indol-3-yl)ethylamino]-oxomethyl]heptanoic acid ethyl ester IUPAC Name: ethyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate Traditional Name: 3-[2-(1H-indol-3-yl)ethylcarbamoyl]-5-methylol-enanthic acid ethyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(=O)OCC)C(=O)NCCC1=CNC2=CC=CC=C21)CO

Isomeric SMILES

CCC(CC(CC(=O)OCC)C(=O)NCCC1=CNC2=CC=CC=C21)CO

InChI

InChI=1S/C21H30N2O4/c1-3-15(14-24)11-17(12-20(25)27-4-2)21(26)22-10-9-16-13-23-19-8-6-5-7-18(16)19/h5-8,13,15,17,23-24H,3-4,9-12,14H2,1-2H3,(H,22,26)