(2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]propanoic acid

Systemtic Name: (2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]propanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]propanoic acid CAS Name: (2S)-2-(phenylmethoxycarbonylamino)-3-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]propanoic acid IUPAC Name: (2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]propanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-[4-(3-pyrrolidinopropoxy)phenyl]propionic acid Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=CC=C(C=C2)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CCCOC2=CC=C(C=C2)C[C@@H](C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O5/c27-23(28)22(25-24(29)31-18-20-7-2-1-3-8-20)17-19-9-11-21(12-10-19)30-16-6-15-26-13-4-5-14-26/h1-3,7-12,22H,4-6,13-18H2,(H,25,29)(H,27,28)/t22-/m0/s1