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

Systemtic Name: butan-2-yl (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate Openeye Name: sec-butyl (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-oxo-1-benzopyran-4-yl)-2-pyrrolidinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-ketochromen-4-yl)pyrrolidine-2-carboxylic acid sec-butyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1CCCN1C2=CC(=O)OC3=CC=CC=C32

Isomeric SMILES

CCC(C)OC(=O)[C@@H]1CCCN1C2=CC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C18H21NO4/c1-3-12(2)22-18(21)14-8-6-10-19(14)15-11-17(20)23-16-9-5-4-7-13(15)16/h4-5,7,9,11-12,14H,3,6,8,10H2,1-2H3/t12?,14-/m0/s1