(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (2-methyl-4-oxo-3-phenoxy-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (2-methyl-4-oxo-3-phenoxy-1-benzopyran-7-yl) ester IUPAC Name: (2-methyl-4-oxo-3-phenoxychromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-butyric acid (4-keto-2-methyl-3-phenoxy-chromen-7-yl) ester Formula: C29H27NO7 MolecularWeight: 501.52718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H27NO7/c1-18(2)25(30-29(33)34-17-20-10-6-4-7-11-20)28(32)37-22-14-15-23-24(16-22)35-19(3)27(26(23)31)36-21-12-8-5-9-13-21/h4-16,18,25H,17H2,1-3H3,(H,30,33)