2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(3-phenylpropoxy)phenyl]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(3-phenylpropoxy)phenyl]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[4-(3-phenylpropoxy)phenyl]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(3-phenylpropoxy)phenyl]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propionic acid Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C23H29NO5/c1-23(2,3)29-22(27)24-20(21(25)26)16-18-11-13-19(14-12-18)28-15-7-10-17-8-5-4-6-9-17/h4-6,8-9,11-14,20H,7,10,15-16H2,1-3H3,(H,24,27)(H,25,26)