2-(4-chloranyl-3-methyl-phenyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-methoxy-quinoline-4-carboxamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-6-methoxy-quinoline-4-carboxamide Openeye Name: 2-(4-chloro-3-methyl-phenyl)-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-6-methoxy-quinoline-4-carboxamide CAS Name: 2-(4-chloro-3-methylphenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-methoxy-4-quinolinecarboxamide IUPAC Name: 2-(4-chloro-3-methylphenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-6-methoxyquinoline-4-carboxamide Traditional Name: 2-(4-chloro-3-methyl-phenyl)-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-6-methoxy-cinchoninamide Formula: C29H26ClN3O3 MolecularWeight: 499.98804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=C(C=C(C=C3)OC)C(=C2)C(=O)NC(CC4=CNC5=CC=CC=C54)CO)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=C(C=C(C=C3)OC)C(=C2)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO)Cl

InChI

InChI=1S/C29H26ClN3O3/c1-17-11-18(7-9-25(17)30)28-14-24(23-13-21(36-2)8-10-27(23)33-28)29(35)32-20(16-34)12-19-15-31-26-6-4-3-5-22(19)26/h3-11,13-15,20,31,34H,12,16H2,1-2H3,(H,32,35)/t20-/m1/s1