(2S,3S)-2-[[(2S)-2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[[(2S)-2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[[(2S)-2-(4-ethyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(2S)-2-[(4-ethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[[(2S)-2-(4-ethyl-2-oxochromen-7-yl)oxypropanoyl]amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[[(2S)-2-(4-ethyl-2-keto-chromen-7-yl)oxypropanoyl]amino]-3-methyl-valerate Formula: C20H24NO6- MolecularWeight: 374.40766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC(C(C)CC)C(=O)[O-]

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)O[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)[O-]

InChI

InChI=1S/C20H25NO6/c1-5-11(3)18(20(24)25)21-19(23)12(4)26-14-7-8-15-13(6-2)9-17(22)27-16(15)10-14/h7-12,18H,5-6H2,1-4H3,(H,21,23)(H,24,25)/p-1/t11-,12-,18-/m0/s1