2-(butan-2-yloxycarbonylamino)-3-(4-chlorophenyl)propanoic acid

Systemtic Name: 2-(butan-2-yloxycarbonylamino)-3-(4-chlorophenyl)propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-(sec-butoxycarbonylamino)propanoic acid CAS Name: 2-[[butan-2-yloxy(oxo)methyl]amino]-3-(4-chlorophenyl)propanoic acid IUPAC Name: 2-(butan-2-yloxycarbonylamino)-3-(4-chlorophenyl)propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-(sec-butoxycarbonylamino)propionic acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)NC(CC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CCC(C)OC(=O)NC(CC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C14H18ClNO4/c1-3-9(2)20-14(19)16-12(13(17)18)8-10-4-6-11(15)7-5-10/h4-7,9,12H,3,8H2,1-2H3,(H,16,19)(H,17,18)