methyl (1S,2S)-1-benzamido-2-(1-ethanoylindol-3-yl)cyclopropane-1-carboxylate

Systemtic Name: methyl (1S,2S)-1-benzamido-2-(1-ethanoylindol-3-yl)cyclopropane-1-carboxylate Openeye Name: methyl (1S,2S)-2-(1-acetylindol-3-yl)-1-benzamido-cyclopropanecarboxylate CAS Name: (1S,2S)-2-(1-acetyl-3-indolyl)-1-benzamido-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S)-2-(1-acetylindol-3-yl)-1-benzamidocyclopropane-1-carboxylate Traditional Name: (1S,2S)-2-(1-acetylindol-3-yl)-1-benzamido-cyclopropanecarboxylic acid methyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=CC=CC=C21)C3CC3(C(=O)OC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C=C(C2=CC=CC=C21)[C@@H]3C[C@]3(C(=O)OC)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O4/c1-14(25)24-13-17(16-10-6-7-11-19(16)24)18-12-22(18,21(27)28-2)23-20(26)15-8-4-3-5-9-15/h3-11,13,18H,12H2,1-2H3,(H,23,26)/t18-,22-/m0/s1