methyl (4S,7E)-7-(methoxymethylidene)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-nonanoate

Systemtic Name: methyl (4S,7E)-7-(methoxymethylidene)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-nonanoate Openeye Name: methyl (4S,7E)-4-(tert-butoxycarbonylamino)-7-(methoxymethylene)-6-oxo-nonanoate CAS Name: (4S,7E)-7-(methoxymethylidene)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxononanoic acid methyl ester IUPAC Name: methyl (4S,7E)-7-(methoxymethylidene)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxononanoate Traditional Name: (E,4S)-4-(tert-butoxycarbonylamino)-7-ethyl-6-keto-8-methoxy-oct-7-enoic acid methyl ester Formula: C17H29NO6 MolecularWeight: 343.41526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=COC)C(=O)CC(CCC(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC/C(=C\OC)/C(=O)C[C@H](CCC(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H29NO6/c1-7-12(11-22-5)14(19)10-13(8-9-15(20)23-6)18-16(21)24-17(2,3)4/h11,13H,7-10H2,1-6H3,(H,18,21)/b12-11+/t13-/m0/s1