propyl 2-[[2-(dodecanoylamino)-3-methyl-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: propyl 2-[[2-(dodecanoylamino)-3-methyl-butanoyl]amino]-3-phenyl-propanoate Openeye Name: propyl 2-[[2-(dodecanoylamino)-3-methyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[3-methyl-1-oxo-2-(1-oxododecylamino)butyl]amino]-3-phenylpropanoic acid propyl ester IUPAC Name: propyl 2-[[2-(dodecanoylamino)-3-methylbutanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(lauroylamino)-3-methyl-butanoyl]amino]-3-phenyl-propionic acid propyl ester Formula: C29H48N2O4 MolecularWeight: 488.70242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)OCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(C(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)OCCC

InChI

InChI=1S/C29H48N2O4/c1-5-7-8-9-10-11-12-13-17-20-26(32)31-27(23(3)4)28(33)30-25(29(34)35-21-6-2)22-24-18-15-14-16-19-24/h14-16,18-19,23,25,27H,5-13,17,20-22H2,1-4H3,(H,30,33)(H,31,32)