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octadecyl 2-azanyl-3-(1H-indol-3-yl)propanoate

octadecyl 2-azanyl-3-(1H-indol-3-yl)propanoate

Systemtic Name:octadecyl 2-azanyl-3-(1H-indol-3-yl)propanoate
Openeye Name:octadecyl 2-amino-3-(1H-indol-3-yl)propanoate
CAS Name:2-amino-3-(1H-indol-3-yl)propanoic acid octadecyl ester
IUPAC Name:octadecyl 2-amino-3-(1H-indol-3-yl)propanoate
Traditional Name:2-amino-3-(1H-indol-3-yl)propionic acid stearyl ester
Formula: C29H48N2O2
MolecularWeight: 456.70362
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CC1=CNC2=CC=CC=C21)N


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CC1=CNC2=CC=CC=C21)N


InChI

InChI=1S/C29H48N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-33-29(32)27(30)23-25-24-31-28-21-18-17-20-26(25)28/h17-18,20-21,24,27,31H,2-16,19,22-23,30H2,1H3


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