4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoylamino]-2-phenyl-benzoic acid

Systemtic Name: 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoylamino]-2-phenyl-benzoic acid Openeye Name: 4-[2-(tert-butoxycarbonylamino)heptanoylamino]-2-phenyl-benzoic acid CAS Name: 4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoheptyl]amino]-2-phenylbenzoic acid IUPAC Name: 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]heptanoylamino]-2-phenylbenzoic acid Traditional Name: 4-[2-(tert-butoxycarbonylamino)heptanoylamino]-2-phenyl-benzoic acid Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC(C(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H32N2O5/c1-5-6-8-13-21(27-24(31)32-25(2,3)4)22(28)26-18-14-15-19(23(29)30)20(16-18)17-11-9-7-10-12-17/h7,9-12,14-16,21H,5-6,8,13H2,1-4H3,(H,26,28)(H,27,31)(H,29,30)