3-(4H-imidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl-naphthalen-1-yl-amino]propanoic acid

Systemtic Name: 3-(4H-imidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl-naphthalen-1-yl-amino]propanoic acid Openeye Name: 2-[2-(tert-butoxycarbonylamino)propanoyl-(1-naphthyl)amino]-3-(4H-imidazol-4-yl)propanoic acid CAS Name: 3-(4H-imidazol-4-yl)-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]-(1-naphthalenyl)amino]propanoic acid IUPAC Name: 3-(4H-imidazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl-naphthalen-1-ylamino]propanoic acid Traditional Name: 2-[2-(tert-butoxycarbonylamino)propanoyl-(1-naphthyl)amino]-3-(4H-imidazol-4-yl)propionic acid Formula: C24H28N4O5 MolecularWeight: 452.50292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC=CC2=CC=CC=C21)C(CC3C=NC=N3)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)N(C1=CC=CC2=CC=CC=C21)C(CC3C=NC=N3)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H28N4O5/c1-15(27-23(32)33-24(2,3)4)21(29)28(20(22(30)31)12-17-13-25-14-26-17)19-11-7-9-16-8-5-6-10-18(16)19/h5-11,13-15,17,20H,12H2,1-4H3,(H,27,32)(H,30,31)