2-cyclohexylpropyl (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate

Systemtic Name: 2-cyclohexylpropyl (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate Openeye Name: 2-cyclohexylpropyl (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-oxo-1-benzopyran-4-yl)-2-pyrrolidinecarboxylic acid 2-cyclohexylpropyl ester IUPAC Name: 2-cyclohexylpropyl (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-ketochromen-4-yl)pyrrolidine-2-carboxylic acid 2-cyclohexylpropyl ester Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1CCCN1C2=CC(=O)OC3=CC=CC=C32)C4CCCCC4

Isomeric SMILES

CC(COC(=O)[C@@H]1CCCN1C2=CC(=O)OC3=CC=CC=C32)C4CCCCC4

InChI

InChI=1S/C23H29NO4/c1-16(17-8-3-2-4-9-17)15-27-23(26)19-11-7-13-24(19)20-14-22(25)28-21-12-6-5-10-18(20)21/h5-6,10,12,14,16-17,19H,2-4,7-9,11,13,15H2,1H3/t16?,19-/m0/s1