4-[[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]amino]butanoic acid

Systemtic Name: 4-[[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]amino]butanoic acid Openeye Name: 4-[4-[4-(tert-butoxycarbonylamino)phenyl]anilino]butanoic acid CAS Name: 4-[4-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]anilino]butanoic acid IUPAC Name: 4-[4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]anilino]butanoic acid Traditional Name: 4-[4-[4-(tert-butoxycarbonylamino)phenyl]anilino]butyric acid Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)NCCCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)NCCCC(=O)O

InChI

InChI=1S/C21H26N2O4/c1-21(2,3)27-20(26)23-18-12-8-16(9-13-18)15-6-10-17(11-7-15)22-14-4-5-19(24)25/h6-13,22H,4-5,14H2,1-3H3,(H,23,26)(H,24,25)