methyl (1S,2S)-2-acetyloxy-1-(1H-indol-2-yl)cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2S)-2-acetyloxy-1-(1H-indol-2-yl)cyclohexane-1-carboxylate Openeye Name: methyl (1S,2S)-2-acetoxy-1-(1H-indol-2-yl)cyclohexanecarboxylate CAS Name: (1S,2S)-2-acetyloxy-1-(1H-indol-2-yl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S)-2-acetyloxy-1-(1H-indol-2-yl)cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-acetoxy-1-(1H-indol-2-yl)cyclohexanecarboxylic acid methyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCCC1(C2=CC3=CC=CC=C3N2)C(=O)OC

Isomeric SMILES

CC(=O)O[C@H]1CCCC[C@@]1(C2=CC3=CC=CC=C3N2)C(=O)OC

InChI

InChI=1S/C18H21NO4/c1-12(20)23-16-9-5-6-10-18(16,17(21)22-2)15-11-13-7-3-4-8-14(13)19-15/h3-4,7-8,11,16,19H,5-6,9-10H2,1-2H3/t16-,18-/m0/s1