3-phenylbutyl (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate

Systemtic Name: 3-phenylbutyl (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate Openeye Name: 3-phenylbutyl (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-oxo-1-benzopyran-4-yl)-2-pyrrolidinecarboxylic acid 3-phenylbutyl ester IUPAC Name: 3-phenylbutyl (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-ketochromen-4-yl)pyrrolidine-2-carboxylic acid 3-phenylbutyl ester Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C1CCCN1C2=CC(=O)OC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(CCOC(=O)[C@@H]1CCCN1C2=CC(=O)OC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H25NO4/c1-17(18-8-3-2-4-9-18)13-15-28-24(27)20-11-7-14-25(20)21-16-23(26)29-22-12-6-5-10-19(21)22/h2-6,8-10,12,16-17,20H,7,11,13-15H2,1H3/t17?,20-/m0/s1