ethyl (3S,4S)-5-(1-methanoylindol-3-yl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-pentanoate

Systemtic Name: ethyl (3S,4S)-5-(1-methanoylindol-3-yl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-pentanoate Openeye Name: ethyl (3S,4S)-4-(tert-butoxycarbonylamino)-5-(1-formylindol-3-yl)-3-hydroxy-pentanoate CAS Name: (3S,4S)-5-(1-formyl-3-indolyl)-3-hydroxy-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl (3S,4S)-5-(1-formylindol-3-yl)-3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (3S,4S)-4-(tert-butoxycarbonylamino)-5-(1-formylindol-3-yl)-3-hydroxy-valeric acid ethyl ester Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(CC1=CN(C2=CC=CC=C21)C=O)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CCOC(=O)C[C@@H]([C@H](CC1=CN(C2=CC=CC=C21)C=O)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H28N2O6/c1-5-28-19(26)11-18(25)16(22-20(27)29-21(2,3)4)10-14-12-23(13-24)17-9-7-6-8-15(14)17/h6-9,12-13,16,18,25H,5,10-11H2,1-4H3,(H,22,27)/t16-,18-/m0/s1