(6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: (6-chloro-2-oxo-4-phenyl-chromen-7-yl) 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(phenylmethoxycarbonylamino)propanoic acid (6-chloro-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-phenylchromen-7-yl) 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)propionic acid (6-chloro-2-keto-4-phenyl-chromen-7-yl) ester Formula: C26H20ClNO6 MolecularWeight: 477.8931

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC(=O)OC2=C(C=C3C(=CC(=O)OC3=C2)C4=CC=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC(=O)OC2=C(C=C3C(=CC(=O)OC3=C2)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H20ClNO6/c27-21-13-20-19(18-9-5-2-6-10-18)14-25(30)33-22(20)15-23(21)34-24(29)11-12-28-26(31)32-16-17-7-3-1-4-8-17/h1-10,13-15H,11-12,16H2,(H,28,31)