(1S,2S,5R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,5-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,2S,5R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,5-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,2S,5R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,5-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,2S,5R)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3,5-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,2S,5R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,5-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,2S,5R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,5-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(=C1)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O

Isomeric SMILES

C[C@@H]1C[C@@H]([C@@H](C(=C1)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O

InChI

InChI=1S/C24H25NO4/c1-14-11-15(2)22(20(12-14)23(26)27)25-24(28)29-13-21-18-9-5-3-7-16(18)17-8-4-6-10-19(17)21/h3-11,14,20-22H,12-13H2,1-2H3,(H,25,28)(H,26,27)/t14-,20-,22+/m0/s1