2-[[5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-3,1-benzoxazin-2-yl]-naphthalen-2-yl-amino]propanoic acid

Systemtic Name: 2-[[5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-3,1-benzoxazin-2-yl]-naphthalen-2-yl-amino]propanoic acid Openeye Name: 2-[[6-(tert-butoxycarbonylamino)-5-methyl-4-oxo-3,1-benzoxazin-2-yl]-(2-naphthyl)amino]propanoic acid CAS Name: 2-[[5-methyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-3,1-benzoxazin-2-yl]-(2-naphthalenyl)amino]propanoic acid IUPAC Name: 2-[[5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-3,1-benzoxazin-2-yl]-naphthalen-2-ylamino]propanoic acid Traditional Name: 2-[[6-(tert-butoxycarbonylamino)-4-keto-5-methyl-3,1-benzoxazin-2-yl]-(2-naphthyl)amino]propionic acid Formula: C27H27N3O6 MolecularWeight: 489.51978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N(C3=CC4=CC=CC=C4C=C3)C(C)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N(C3=CC4=CC=CC=C4C=C3)C(C)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H27N3O6/c1-15-20(29-26(34)36-27(3,4)5)12-13-21-22(15)24(33)35-25(28-21)30(16(2)23(31)32)19-11-10-17-8-6-7-9-18(17)14-19/h6-14,16H,1-5H3,(H,29,34)(H,31,32)