hexadecyl 6-azanyl-2-[[2-(2-azanylethanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoate

Systemtic Name: hexadecyl 6-azanyl-2-[[2-(2-azanylethanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoate Openeye Name: hexadecyl 6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoate CAS Name: 6-amino-2-[[2-[(2-amino-1-oxoethyl)amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]hexanoic acid hexadecyl ester IUPAC Name: hexadecyl 6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoate Traditional Name: 6-amino-2-[[2-(glycylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]hexanoic acid cetyl ester Formula: C30H56N6O4 MolecularWeight: 564.80344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(CCCCN)NC(=O)C(CC1=CN=CN1)NC(=O)CN

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C(CCCCN)NC(=O)C(CC1=CN=CN1)NC(=O)CN

InChI

InChI=1S/C30H56N6O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-40-30(39)26(18-15-16-19-31)36-29(38)27(35-28(37)22-32)21-25-23-33-24-34-25/h23-24,26-27H,2-22,31-32H2,1H3,(H,33,34)(H,35,37)(H,36,38)