(8S)-8-(chloromethyl)-6-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxy-2-(trifluoromethyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylic acid

Systemtic Name: (8S)-8-(chloromethyl)-6-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxy-2-(trifluoromethyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylic acid Openeye Name: (8S)-4-benzyloxy-6-tert-butoxycarbonyl-8-(chloromethyl)-2-(trifluoromethyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylic acid CAS Name: (8S)-8-(chloromethyl)-6-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylmethoxy-2-(trifluoromethyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylic acid IUPAC Name: (8S)-8-(chloromethyl)-6-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxy-2-(trifluoromethyl)-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylic acid Traditional Name: (8S)-4-benzoxy-6-tert-butoxycarbonyl-8-(chloromethyl)-2-(trifluoromethyl)-7,8-dihydro-3H-pyrrol[3,2-e]indole-1-carboxylic acid Formula: C25H24ClF3N2O5 MolecularWeight: 524.91667

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C2=C3C(=C(NC3=C(C=C21)OCC4=CC=CC=C4)C(F)(F)F)C(=O)O)CCl

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H](C2=C3C(=C(NC3=C(C=C21)OCC4=CC=CC=C4)C(F)(F)F)C(=O)O)CCl

InChI

InChI=1S/C25H24ClF3N2O5/c1-24(2,3)36-23(34)31-11-14(10-26)17-15(31)9-16(35-12-13-7-5-4-6-8-13)20-18(17)19(22(32)33)21(30-20)25(27,28)29/h4-9,14,30H,10-12H2,1-3H3,(H,32,33)/t14-/m1/s1