O4-[(2S)-5-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[(2S)-5-azanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[(2S)-5-amino-2-(tert-butoxycarbonylamino)-5-oxo-pentyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[(2S)-5-amino-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentyl] ester O1-ethyl ester IUPAC Name: 4-O-[(2S)-5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[(2S)-5-amino-2-(tert-butoxycarbonylamino)-5-keto-pentyl] ester O1-ethyl ester Formula: C16H26N2O7 MolecularWeight: 358.38684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(CCC(=O)N)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OC[C@H](CCC(=O)N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H26N2O7/c1-5-23-13(20)8-9-14(21)24-10-11(6-7-12(17)19)18-15(22)25-16(2,3)4/h8-9,11H,5-7,10H2,1-4H3,(H2,17,19)(H,18,22)/b9-8+/t11-/m0/s1