(4-methyl-2-oxidanylidene-3-propyl-chromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (4-methyl-2-oxidanylidene-3-propyl-chromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4-methyl-2-oxo-3-propyl-chromen-7-yl) 2-(benzyloxycarbonylamino)propanoate CAS Name: 2-(phenylmethoxycarbonylamino)propanoic acid (4-methyl-2-oxo-3-propyl-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxo-3-propylchromen-7-yl) 2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)propionic acid (2-keto-4-methyl-3-propyl-chromen-7-yl) ester Formula: C24H25NO6 MolecularWeight: 423.4584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(C=C(C=C2)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3)OC1=O)C

Isomeric SMILES

CCCC1=C(C2=C(C=C(C=C2)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3)OC1=O)C

InChI

InChI=1S/C24H25NO6/c1-4-8-20-15(2)19-12-11-18(13-21(19)31-23(20)27)30-22(26)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)