dimethyl 2-(1H-indol-3-ylmethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-pentanedioate

Systemtic Name: dimethyl 2-(1H-indol-3-ylmethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-pentanedioate Openeye Name: dimethyl 4-(tert-butoxycarbonylamino)-2-hydroxy-2-(1H-indol-3-ylmethyl)pentanedioate CAS Name: 2-hydroxy-2-(1H-indol-3-ylmethyl)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-hydroxy-2-(1H-indol-3-ylmethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Traditional Name: 4-(tert-butoxycarbonylamino)-2-hydroxy-2-(1H-indol-3-ylmethyl)glutaric acid dimethyl ester Formula: C21H28N2O7 MolecularWeight: 420.45622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(CC1=CNC2=CC=CC=C21)(C(=O)OC)O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(CC1=CNC2=CC=CC=C21)(C(=O)OC)O)C(=O)OC

InChI

InChI=1S/C21H28N2O7/c1-20(2,3)30-19(26)23-16(17(24)28-4)11-21(27,18(25)29-5)10-13-12-22-15-9-7-6-8-14(13)15/h6-9,12,16,22,27H,10-11H2,1-5H3,(H,23,26)