3-[(4-butylphenyl)methoxycarbonylamino]-2-methyl-2-phenyl-propanoic acid

Systemtic Name: 3-[(4-butylphenyl)methoxycarbonylamino]-2-methyl-2-phenyl-propanoic acid Openeye Name: 3-[(4-butylphenyl)methoxycarbonylamino]-2-methyl-2-phenyl-propanoic acid CAS Name: 3-[[(4-butylphenyl)methoxy-oxomethyl]amino]-2-methyl-2-phenylpropanoic acid IUPAC Name: 3-[(4-butylphenyl)methoxycarbonylamino]-2-methyl-2-phenylpropanoic acid Traditional Name: 3-[(4-butylbenzyl)oxycarbonylamino]-2-methyl-2-phenyl-propionic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)COC(=O)NCC(C)(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)COC(=O)NCC(C)(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H27NO4/c1-3-4-8-17-11-13-18(14-12-17)15-27-21(26)23-16-22(2,20(24)25)19-9-6-5-7-10-19/h5-7,9-14H,3-4,8,15-16H2,1-2H3,(H,23,26)(H,24,25)