N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-nitro-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-nitro-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-6-nitro-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-nitro-2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-nitro-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-6-nitro-2-(3,4,5-trimethoxyphenyl)cinchoninamide Formula: C30H28N4O7 MolecularWeight: 556.56592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=C2)C(=O)NC(CC4=CNC5=CC=CC=C54)CO

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=C2)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO

InChI

InChI=1S/C30H28N4O7/c1-39-27-11-17(12-28(40-2)29(27)41-3)26-14-23(22-13-20(34(37)38)8-9-25(22)33-26)30(36)32-19(16-35)10-18-15-31-24-7-5-4-6-21(18)24/h4-9,11-15,19,31,35H,10,16H2,1-3H3,(H,32,36)/t19-/m1/s1