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

Systemtic Name: (7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (7-methyl-2-oxo-4-propyl-chromen-5-yl) 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-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) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (2-keto-7-methyl-4-propyl-chromen-5-yl) ester Formula: C30H29NO6 MolecularWeight: 499.55436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H29NO6/c1-3-10-23-18-27(32)36-25-15-20(2)16-26(28(23)25)37-29(33)24(17-21-11-6-4-7-12-21)31-30(34)35-19-22-13-8-5-9-14-22/h4-9,11-16,18,24H,3,10,17,19H2,1-2H3,(H,31,34)