tert-butyl (2S)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoate

Systemtic Name: tert-butyl (2S)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoate Openeye Name: tert-butyl (2S)-2-[bis(tert-butoxycarbonyl)amino]-3-(6-nitro-1H-indol-3-yl)propanoate CAS Name: (2S)-2-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(6-nitro-1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[bis(tert-butoxycarbonyl)amino]-3-(6-nitro-1H-indol-3-yl)propionic acid tert-butyl ester Formula: C25H35N3O8 MolecularWeight: 505.5607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-])N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-])N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H35N3O8/c1-23(2,3)34-20(29)19(12-15-14-26-18-13-16(28(32)33)10-11-17(15)18)27(21(30)35-24(4,5)6)22(31)36-25(7,8)9/h10-11,13-14,19,26H,12H2,1-9H3/t19-/m0/s1