3-[4-[3-[[1-(4-acetyloxyphenyl)-3-methyl-butyl]amino]-3-oxidanylidene-propyl]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[4-[3-[[1-(4-acetyloxyphenyl)-3-methyl-butyl]amino]-3-oxidanylidene-propyl]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 3-[4-[3-[[1-(4-acetoxyphenyl)-3-methyl-butyl]amino]-3-oxo-propyl]phenyl]-2-(tert-butoxycarbonylamino)propanoic acid CAS Name: 3-[4-[3-[[1-(4-acetyloxyphenyl)-3-methylbutyl]amino]-3-oxopropyl]phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-[3-[[1-(4-acetyloxyphenyl)-3-methylbutyl]amino]-3-oxopropyl]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-[4-[3-[[1-(4-acetoxyphenyl)-3-methyl-butyl]amino]-3-keto-propyl]phenyl]-2-(tert-butoxycarbonylamino)propionic acid Formula: C30H40N2O7 MolecularWeight: 540.6478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC(=O)C)NC(=O)CCC2=CC=C(C=C2)CC(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC(=O)C)NC(=O)CCC2=CC=C(C=C2)CC(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H40N2O7/c1-19(2)17-25(23-12-14-24(15-13-23)38-20(3)33)31-27(34)16-11-21-7-9-22(10-8-21)18-26(28(35)36)32-29(37)39-30(4,5)6/h7-10,12-15,19,25-26H,11,16-18H2,1-6H3,(H,31,34)(H,32,37)(H,35,36)