octadecyl 2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: octadecyl 2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoate Openeye Name: octadecyl 2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-[(3-amino-1-oxopropyl)amino]-3-(1H-imidazol-5-yl)propanoic acid octadecyl ester IUPAC Name: octadecyl 2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoate Traditional Name: 2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propionic acid stearyl ester Formula: C27H50N4O3 MolecularWeight: 478.7109

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CC1=CN=CN1)NC(=O)CCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CC1=CN=CN1)NC(=O)CCN

InChI

InChI=1S/C27H50N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-34-27(33)25(31-26(32)18-19-28)21-24-22-29-23-30-24/h22-23,25H,2-21,28H2,1H3,(H,29,30)(H,31,32)