1-(3-hexyl-4-oxidanylidene-oxetan-2-yl)tridecan-2-yl 3-azanyl-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: 1-(3-hexyl-4-oxidanylidene-oxetan-2-yl)tridecan-2-yl 3-azanyl-3-oxidanylidene-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: 1-[(3-hexyl-4-oxo-oxetan-2-yl)methyl]dodecyl 3-amino-2-(benzyloxycarbonylamino)-3-oxo-propanoate CAS Name: 3-amino-3-oxo-2-(phenylmethoxycarbonylamino)propanoic acid 1-(3-hexyl-4-oxo-2-oxetanyl)tridecan-2-yl ester IUPAC Name: 1-(3-hexyl-4-oxooxetan-2-yl)tridecan-2-yl 3-amino-3-oxo-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-amino-2-(benzyloxycarbonylamino)-3-keto-propionic acid 1-[(3-hexyl-4-keto-oxetan-2-yl)methyl]dodecyl ester Formula: C33H52N2O7 MolecularWeight: 588.77518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(C(=O)N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(C(=O)N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C33H52N2O7/c1-3-5-7-9-10-11-12-13-17-21-26(23-28-27(31(37)42-28)22-18-8-6-4-2)41-32(38)29(30(34)36)35-33(39)40-24-25-19-15-14-16-20-25/h14-16,19-20,26-29H,3-13,17-18,21-24H2,1-2H3,(H2,34,36)(H,35,39)