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

Systemtic Name: tert-butyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate Openeye Name: tert-butyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate CAS Name: 5-(hydroxymethyl)-3-[[2-(1H-indol-3-yl)ethylamino]-oxomethyl]heptanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-(hydroxymethyl)-3-[2-(1H-indol-3-yl)ethylcarbamoyl]heptanoate Traditional Name: 3-[2-(1H-indol-3-yl)ethylcarbamoyl]-5-methylol-enanthic acid tert-butyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O4/c1-5-16(15-26)12-18(13-21(27)29-23(2,3)4)22(28)24-11-10-17-14-25-20-9-7-6-8-19(17)20/h6-9,14,16,18,25-26H,5,10-13,15H2,1-4H3,(H,24,28)