methyl 4-[4-oxidanylidene-7-[3-(phenylmethoxycarbonylamino)propanoyloxy]chromen-3-yl]oxybenzoate

Systemtic Name: methyl 4-[4-oxidanylidene-7-[3-(phenylmethoxycarbonylamino)propanoyloxy]chromen-3-yl]oxybenzoate Openeye Name: methyl 4-[7-[3-(benzyloxycarbonylamino)propanoyloxy]-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[4-oxo-7-[1-oxo-3-(phenylmethoxycarbonylamino)propoxy]-1-benzopyran-3-yl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[4-oxo-7-[3-(phenylmethoxycarbonylamino)propanoyloxy]chromen-3-yl]oxybenzoate Traditional Name: 4-[7-[3-(benzyloxycarbonylamino)propanoyloxy]-4-keto-chromen-3-yl]oxybenzoic acid methyl ester Formula: C28H23NO9 MolecularWeight: 517.48352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H23NO9/c1-34-27(32)19-7-9-20(10-8-19)37-24-17-35-23-15-21(11-12-22(23)26(24)31)38-25(30)13-14-29-28(33)36-16-18-5-3-2-4-6-18/h2-12,15,17H,13-14,16H2,1H3,(H,29,33)