2-[1,3-dioxan-2-ylmethyl-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]amino]propanoic acid

Systemtic Name: 2-[1,3-dioxan-2-ylmethyl-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]amino]propanoic acid Openeye Name: 2-[1,3-dioxan-2-ylmethyl-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]amino]propanoic acid CAS Name: 2-[1,3-dioxan-2-ylmethyl-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]amino]propanoic acid IUPAC Name: 2-[1,3-dioxan-2-ylmethyl-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]amino]propanoic acid Traditional Name: 2-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl-(1,3-dioxan-2-ylmethyl)amino]propionic acid Formula: C23H34N2O7 MolecularWeight: 450.52526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC2OCCCO2)C(C)C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC2OCCCO2)C(C)C(=O)O

InChI

InChI=1S/C23H34N2O7/c1-4-30-23(29)19(12-11-18-9-6-5-7-10-18)24-16(2)21(26)25(17(3)22(27)28)15-20-31-13-8-14-32-20/h5-7,9-10,16-17,19-20,24H,4,8,11-15H2,1-3H3,(H,27,28)