(3R)-3-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (3R)-3-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-phenyl-propanoic acid Openeye Name: (3R)-3-(N-tert-butoxycarbonyl-4-methoxy-anilino)-3-phenyl-propanoic acid CAS Name: (3R)-3-(4-methoxy-N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino)-3-phenylpropanoic acid IUPAC Name: (3R)-3-[4-methoxy-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-3-phenylpropanoic acid Traditional Name: (3R)-3-(N-tert-butoxycarbonyl-4-methoxy-anilino)-3-phenyl-propionic acid Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=CC=C(C=C1)OC)C(CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC=C(C=C1)OC)[C@H](CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C21H25NO5/c1-21(2,3)27-20(25)22(16-10-12-17(26-4)13-11-16)18(14-19(23)24)15-8-6-5-7-9-15/h5-13,18H,14H2,1-4H3,(H,23,24)/t18-/m1/s1