(7-methyl-2-oxidanylidene-4-phenyl-chromen-5-yl) 3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-4-phenyl-chromen-5-yl) 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: (7-methyl-2-oxo-4-phenyl-chromen-5-yl) 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(phenylmethoxycarbonylamino)propanoic acid (7-methyl-2-oxo-4-phenyl-1-benzopyran-5-yl) ester IUPAC Name: (7-methyl-2-oxo-4-phenylchromen-5-yl) 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)propionic acid (2-keto-7-methyl-4-phenyl-chromen-5-yl) ester Formula: C27H23NO6 MolecularWeight: 457.47462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C3=CC=CC=C3)C(=C1)OC(=O)CCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C3=CC=CC=C3)C(=C1)OC(=O)CCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H23NO6/c1-18-14-22(26-21(20-10-6-3-7-11-20)16-25(30)34-23(26)15-18)33-24(29)12-13-28-27(31)32-17-19-8-4-2-5-9-19/h2-11,14-16H,12-13,17H2,1H3,(H,28,31)