undec-10-enyl (2S)-2-(butoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: undec-10-enyl (2S)-2-(butoxycarbonylamino)-3-phenyl-propanoate Openeye Name: undec-10-enyl (2S)-2-(butoxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[butoxy(oxo)methyl]amino]-3-phenylpropanoic acid undec-10-enyl ester IUPAC Name: undec-10-enyl (2S)-2-(butoxycarbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(butoxycarbonylamino)-3-phenyl-propionic acid undec-10-enyl ester Formula: C25H39NO4 MolecularWeight: 417.58146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC1=CC=CC=C1)C(=O)OCCCCCCCCCC=C

Isomeric SMILES

CCCCOC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OCCCCCCCCCC=C

InChI

InChI=1S/C25H39NO4/c1-3-5-7-8-9-10-11-12-16-20-29-24(27)23(21-22-17-14-13-15-18-22)26-25(28)30-19-6-4-2/h3,13-15,17-18,23H,1,4-12,16,19-21H2,2H3,(H,26,28)/t23-/m0/s1