(E)-4-[(2S)-3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]sulfanyl-2-methyl-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2S)-3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-propyl]sulfanyl-2-methyl-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(2S)-2-(tert-butoxycarbonylamino)-3-ethoxy-3-oxo-propyl]sulfanyl-2-methyl-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[(2S)-3-ethoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxopropyl]thio]-2-methyl-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(2S)-3-ethoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxopropyl]sulfanyl-2-methyl-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[(2S)-2-(tert-butoxycarbonylamino)-3-ethoxy-3-keto-propyl]thio]-4-keto-2-methyl-but-2-enoic acid Formula: C15H23NO7S MolecularWeight: 361.41062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC(=O)C=C(C)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H](CSC(=O)/C=C(\C)/C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C15H23NO7S/c1-6-22-13(20)10(16-14(21)23-15(3,4)5)8-24-11(17)7-9(2)12(18)19/h7,10H,6,8H2,1-5H3,(H,16,21)(H,18,19)/b9-7+/t10-/m1/s1