[4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl] 3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [4-(4-methoxyphenyl)-8-methyl-2-oxidanylidene-chromen-7-yl] 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: [4-(4-methoxyphenyl)-8-methyl-2-oxo-chromen-7-yl] 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(phenylmethoxycarbonylamino)propanoic acid [4-(4-methoxyphenyl)-8-methyl-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [4-(4-methoxyphenyl)-8-methyl-2-oxochromen-7-yl] 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)propionic acid [2-keto-4-(4-methoxyphenyl)-8-methyl-chromen-7-yl] ester Formula: C28H25NO7 MolecularWeight: 487.5006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)CCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)CCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H25NO7/c1-18-24(35-25(30)14-15-29-28(32)34-17-19-6-4-3-5-7-19)13-12-22-23(16-26(31)36-27(18)22)20-8-10-21(33-2)11-9-20/h3-13,16H,14-15,17H2,1-2H3,(H,29,32)