2-[(2-methylpropan-2-yl)oxycarbonyl-piperazin-1-ylcarbonyl-amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-piperazin-1-ylcarbonyl-amino]-3-phenyl-propanoic acid Openeye Name: 2-[tert-butoxycarbonyl(piperazine-1-carbonyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[oxo(1-piperazinyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-(piperazine-1-carbonyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[tert-butoxycarbonyl(piperazine-1-carbonyl)amino]-3-phenyl-propionic acid Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CC1=CC=CC=C1)C(=O)O)C(=O)N2CCNCC2

Isomeric SMILES

CC(C)(C)OC(=O)N(C(CC1=CC=CC=C1)C(=O)O)C(=O)N2CCNCC2

InChI

InChI=1S/C19H27N3O5/c1-19(2,3)27-18(26)22(17(25)21-11-9-20-10-12-21)15(16(23)24)13-14-7-5-4-6-8-14/h4-8,15,20H,9-13H2,1-3H3,(H,23,24)