hexadecyl 2-azanyl-3-(1-ethanoylindol-3-yl)propanoate

Systemtic Name: hexadecyl 2-azanyl-3-(1-ethanoylindol-3-yl)propanoate Openeye Name: hexadecyl 3-(1-acetylindol-3-yl)-2-amino-propanoate CAS Name: 3-(1-acetyl-3-indolyl)-2-aminopropanoic acid hexadecyl ester IUPAC Name: hexadecyl 3-(1-acetylindol-3-yl)-2-aminopropanoate Traditional Name: 3-(1-acetylindol-3-yl)-2-amino-propionic acid cetyl ester Formula: C29H46N2O3 MolecularWeight: 470.68714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(CC1=CN(C2=CC=CC=C21)C(=O)C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(CC1=CN(C2=CC=CC=C21)C(=O)C)N

InChI

InChI=1S/C29H46N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-34-29(33)27(30)22-25-23-31(24(2)32)28-20-17-16-19-26(25)28/h16-17,19-20,23,27H,3-15,18,21-22,30H2,1-2H3