(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (7-methyl-2-oxo-4-propyl-chromen-5-yl) (2S)-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid (7-methyl-2-oxo-4-propyl-1-benzopyran-5-yl) ester IUPAC Name: (7-methyl-2-oxo-4-propylchromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)propionic acid (2-keto-7-methyl-4-propyl-chromen-5-yl) ester Formula: C24H25NO6 MolecularWeight: 423.4584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)[C@H](C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H25NO6/c1-4-8-18-13-21(26)30-19-11-15(2)12-20(22(18)19)31-23(27)16(3)25-24(28)29-14-17-9-6-5-7-10-17/h5-7,9-13,16H,4,8,14H2,1-3H3,(H,25,28)/t16-/m0/s1