methyl (2S)-2-benzamido-3-[2,5-bis(oxidanylidene)-7,8-dihydro-6H-chromen-3-yl]propanoate

Systemtic Name: methyl (2S)-2-benzamido-3-[2,5-bis(oxidanylidene)-7,8-dihydro-6H-chromen-3-yl]propanoate Openeye Name: methyl (2S)-2-benzamido-3-(2,5-dioxo-7,8-dihydro-6H-chromen-3-yl)propanoate CAS Name: (2S)-2-benzamido-3-(2,5-dioxo-7,8-dihydro-6H-1-benzopyran-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-benzamido-3-(2,5-dioxo-7,8-dihydro-6H-chromen-3-yl)propanoate Traditional Name: (2S)-2-benzamido-3-(2,5-diketo-7,8-dihydro-6H-chromen-3-yl)propionic acid methyl ester Formula: C20H19NO6 MolecularWeight: 369.36796

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC2=C(CCCC2=O)OC1=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=CC2=C(CCCC2=O)OC1=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H19NO6/c1-26-20(25)15(21-18(23)12-6-3-2-4-7-12)11-13-10-14-16(22)8-5-9-17(14)27-19(13)24/h2-4,6-7,10,15H,5,8-9,11H2,1H3,(H,21,23)/t15-/m0/s1